Pyrimidines And Derivatives

Aromatic organic compounds that consist of an aromatic six-membered ring containing two non-adjacent nitrogen atoms and four carbon atoms; includes compounds derived from pyrimidines.

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Thiamine hydrochloride, 99% (dry wt.), may cont. up to 5% water

CAS: 67-03-8 Molecular Formula: C12H18Cl2N4OS Molecular Weight (g/mol): 337.263 MDL Number: MFCD00012780 InChI Key: DPJRMOMPQZCRJU-UHFFFAOYSA-M Synonym: thiamine hydrochloride,vitamin b1 hydrochloride,thiamine hcl,aneurine hydrochloride,berin,thiamine chloride hydrochloride,trophite,thiamin chloride,thiamine dichloride,thiaminium chloride PubChem CID: 6202 ChEBI: CHEBI:49105 IUPAC Name: 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride;hydrochloride SMILES: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]

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Specifications

PubChem CID	6202
CAS	67-03-8
Molecular Weight (g/mol)	337.263
ChEBI	CHEBI:49105
MDL Number	MFCD00012780
SMILES	CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]
Synonym	thiamine hydrochloride,vitamin b1 hydrochloride,thiamine hcl,aneurine hydrochloride,berin,thiamine chloride hydrochloride,trophite,thiamin chloride,thiamine dichloride,thiaminium chloride
IUPAC Name	2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride;hydrochloride
InChI Key	DPJRMOMPQZCRJU-UHFFFAOYSA-M
Molecular Formula	C12H18Cl2N4OS

Guanine, 98%

CAS: 73-40-5 Molecular Formula: C5H5N5O Molecular Weight (g/mol): 151.13 MDL Number: MFCD00071533 InChI Key: UYTPUPDQBNUYGX-UHFFFAOYSA-N Synonym: guanine,2-amino-6-hydroxypurine,guanin,2-aminohypoxanthine,mearlmaid,pearl essence,guanine enol,stella polaris,dew pearl,natural pearl essence PubChem CID: 764 ChEBI: CHEBI:16235 SMILES: NC1=NC(=O)C2=C(N1)N=CN2

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Specifications

PubChem CID	764
CAS	73-40-5
Molecular Weight (g/mol)	151.13
ChEBI	CHEBI:16235
MDL Number	MFCD00071533
SMILES	NC1=NC(=O)C2=C(N1)N=CN2
Synonym	guanine,2-amino-6-hydroxypurine,guanin,2-aminohypoxanthine,mearlmaid,pearl essence,guanine enol,stella polaris,dew pearl,natural pearl essence
InChI Key	UYTPUPDQBNUYGX-UHFFFAOYSA-N
Molecular Formula	C5H5N5O

Thermo Scientific Chemicals Cytosine, 98+%

CAS: 71-30-7 Molecular Formula: C4H5N3O Molecular Weight (g/mol): 111.10 MDL Number: MFCD00006034 InChI Key: OPTASPLRGRRNAP-UHFFFAOYSA-N Synonym: cytosine,4-amino-2-hydroxypyrimidine,cytosinimine,2 1h-pyrimidinone, 4-amino,4-amino-2 1h-pyrimidinone,4-aminopyrimidin-2 1h-one,6-aminopyrimidin-2 1h-one,2 1h-pyrimidinone, 6-amino,cyt,4-amino-2-oxo-1,2-dihydropyrimidine PubChem CID: 597 ChEBI: CHEBI:16040 SMILES: NC1=CC=NC(=O)N1

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Specifications

PubChem CID	597
CAS	71-30-7
Molecular Weight (g/mol)	111.10
ChEBI	CHEBI:16040
MDL Number	MFCD00006034
SMILES	NC1=CC=NC(=O)N1
Synonym	cytosine,4-amino-2-hydroxypyrimidine,cytosinimine,2 1h-pyrimidinone, 4-amino,4-amino-2 1h-pyrimidinone,4-aminopyrimidin-2 1h-one,6-aminopyrimidin-2 1h-one,2 1h-pyrimidinone, 6-amino,cyt,4-amino-2-oxo-1,2-dihydropyrimidine
InChI Key	OPTASPLRGRRNAP-UHFFFAOYSA-N
Molecular Formula	C4H5N3O

5-Fluorocytosine, 98+%

CAS: 2022-85-7 Molecular Formula: C4H4FN3O Molecular Weight (g/mol): 129.09 MDL Number: MFCD00006035,MFCD00179326,MFCD03547958 InChI Key: XRECTZIEBJDKEO-UHFFFAOYSA-N Synonym: 5-fluorocytosine,flucytosine,ancotil,ancobon,flucytosin,5-fluorocystosine,fluocytosine,5-fc,5-fluorocytosin,fluorcytosine PubChem CID: 3366 ChEBI: CHEBI:5100 SMILES: NC1=C(F)C=NC(=O)N1

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Specifications

PubChem CID	3366
CAS	2022-85-7
Molecular Weight (g/mol)	129.09
ChEBI	CHEBI:5100
MDL Number	MFCD00006035,MFCD00179326,MFCD03547958
SMILES	NC1=C(F)C=NC(=O)N1
Synonym	5-fluorocytosine,flucytosine,ancotil,ancobon,flucytosin,5-fluorocystosine,fluocytosine,5-fc,5-fluorocytosin,fluorcytosine
InChI Key	XRECTZIEBJDKEO-UHFFFAOYSA-N
Molecular Formula	C4H4FN3O

Thermo Scientific Chemicals Uracil, 99+%

CAS: 66-22-8 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.09 MDL Number: MFCD00006016 InChI Key: ISAKRJDGNUQOIC-UHFFFAOYSA-N Synonym: uracil,2,4-dihydroxypyrimidine,2,4 1h,3h-pyrimidinedione,2,4-pyrimidinediol,2,4-dioxopyrimidine,pyrimidine-2,4 1h,3h-dione,pirod,2,4-pyrimidinedione,pyrod,hybar x PubChem CID: 1174 ChEBI: CHEBI:17568 IUPAC Name: 1H-pyrimidine-2,4-dione SMILES: O=C1NC=CC(=O)N1

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Specifications

PubChem CID	1174
CAS	66-22-8
Molecular Weight (g/mol)	112.09
ChEBI	CHEBI:17568
MDL Number	MFCD00006016
SMILES	O=C1NC=CC(=O)N1
Synonym	uracil,2,4-dihydroxypyrimidine,2,4 1h,3h-pyrimidinedione,2,4-pyrimidinediol,2,4-dioxopyrimidine,pyrimidine-2,4 1h,3h-dione,pirod,2,4-pyrimidinedione,pyrod,hybar x
IUPAC Name	1H-pyrimidine-2,4-dione
InChI Key	ISAKRJDGNUQOIC-UHFFFAOYSA-N
Molecular Formula	C4H4N2O2

5-Fluorouracil, 99%

CAS: 51-21-8 Molecular Formula: C4H3FN2O2 Molecular Weight (g/mol): 130.08 MDL Number: MFCD00006018 InChI Key: GHASVSINZRGABV-UHFFFAOYSA-N Synonym: 5-fluorouracil,fluorouracil,5-fu,fluoroplex,adrucil,efudex,carac,fluracil,fluoroblastin,kecimeton PubChem CID: 3385 ChEBI: CHEBI:46345 IUPAC Name: 5-fluoro-1H-pyrimidine-2,4-dione SMILES: FC1=CNC(=O)NC1=O

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Specifications

PubChem CID	3385
CAS	51-21-8
Molecular Weight (g/mol)	130.08
ChEBI	CHEBI:46345
MDL Number	MFCD00006018
SMILES	FC1=CNC(=O)NC1=O
Synonym	5-fluorouracil,fluorouracil,5-fu,fluoroplex,adrucil,efudex,carac,fluracil,fluoroblastin,kecimeton
IUPAC Name	5-fluoro-1H-pyrimidine-2,4-dione
InChI Key	GHASVSINZRGABV-UHFFFAOYSA-N
Molecular Formula	C4H3FN2O2

2-Amino-5-iodopyrimidine, 97%

CAS: 1445-39-2 Molecular Formula: C4H4IN3 Molecular Weight (g/mol): 221.001 MDL Number: MFCD01075666 InChI Key: HAFKCGZQRIIADX-UHFFFAOYSA-N Synonym: 2-amino-5-iodopyrimidine,2-amino-5-iodo-pyrimidine,5-iodo-pyrimidin-2-ylamine,5-iodopyrimidine-2-ylamine,zlchem 484,5-iodo-2-pyrimidinamine,2-pyrimidinamine, 5-iodo,acmc-1c050 PubChem CID: 241102 IUPAC Name: 5-iodopyrimidin-2-amine SMILES: C1=C(C=NC(=N1)N)I

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Specifications

PubChem CID	241102
CAS	1445-39-2
Molecular Weight (g/mol)	221.001
MDL Number	MFCD01075666
SMILES	C1=C(C=NC(=N1)N)I
Synonym	2-amino-5-iodopyrimidine,2-amino-5-iodo-pyrimidine,5-iodo-pyrimidin-2-ylamine,5-iodopyrimidine-2-ylamine,zlchem 484,5-iodo-2-pyrimidinamine,2-pyrimidinamine, 5-iodo,acmc-1c050
IUPAC Name	5-iodopyrimidin-2-amine
InChI Key	HAFKCGZQRIIADX-UHFFFAOYSA-N
Molecular Formula	C4H4IN3

Orotic acid, anhydrous, 97%

CAS: 65-86-1 Molecular Formula: C5H4N2O4 Molecular Weight (g/mol): 156.097 MDL Number: MFCD00006027 InChI Key: PXQPEWDEAKTCGB-UHFFFAOYSA-N Synonym: orotic acid,6-carboxyuracil,orodin,oropur,orotonin,orotonsan,oroturic,orotyl,vitamin b13,whey factor PubChem CID: 967 ChEBI: CHEBI:16742 IUPAC Name: 2,4-dioxo-1H-pyrimidine-6-carboxylic acid SMILES: C1=C(NC(=O)NC1=O)C(=O)O

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Specifications

PubChem CID	967
CAS	65-86-1
Molecular Weight (g/mol)	156.097
ChEBI	CHEBI:16742
MDL Number	MFCD00006027
SMILES	C1=C(NC(=O)NC1=O)C(=O)O
Synonym	orotic acid,6-carboxyuracil,orodin,oropur,orotonin,orotonsan,oroturic,orotyl,vitamin b13,whey factor
IUPAC Name	2,4-dioxo-1H-pyrimidine-6-carboxylic acid
InChI Key	PXQPEWDEAKTCGB-UHFFFAOYSA-N
Molecular Formula	C5H4N2O4

2-Amino-6-bromopurine, 98%

CAS: 82499-03-4 Molecular Formula: C5H4BrN5 Molecular Weight (g/mol): 214.026 MDL Number: MFCD01321309 InChI Key: HPGBGNVPUMCKPM-UHFFFAOYSA-N Synonym: 2-amino-6-bromopurine,6-bromo-9h-purin-2-amine,1h-purin-2-amine, 6-bromo,6-bromoguanine,d2-amino-6-bromopurine,6-bromopurine-2-ylamine,purine, 2-amino-6-bromo,6-bromo-9h-purin-2-ylamine,9h-purin-2-amine,6-bromo PubChem CID: 6101139 IUPAC Name: 6-bromo-7H-purin-2-amine SMILES: C1=NC2=C(N1)C(=NC(=N2)N)Br

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Specifications

PubChem CID	6101139
CAS	82499-03-4
Molecular Weight (g/mol)	214.026
MDL Number	MFCD01321309
SMILES	C1=NC2=C(N1)C(=NC(=N2)N)Br
Synonym	2-amino-6-bromopurine,6-bromo-9h-purin-2-amine,1h-purin-2-amine, 6-bromo,6-bromoguanine,d2-amino-6-bromopurine,6-bromopurine-2-ylamine,purine, 2-amino-6-bromo,6-bromo-9h-purin-2-ylamine,9h-purin-2-amine,6-bromo
IUPAC Name	6-bromo-7H-purin-2-amine
InChI Key	HPGBGNVPUMCKPM-UHFFFAOYSA-N
Molecular Formula	C5H4BrN5

5-Amino-4,6-dichloropyrimidine, 98+%

CAS: 5413-85-4 Molecular Formula: C4H3Cl2N3 Molecular Weight (g/mol): 163.99 MDL Number: MFCD00006108 InChI Key: NIGDWBHWHVHOAD-UHFFFAOYSA-N Synonym: 5-amino-4,6-dichloropyrimidine,5-pyrimidinamine, 4,6-dichloro,4,6-dichloro-5-pyrimidinamine,4,6-dichloro-5-aminopyrimidine,4,6-dichloropyrimidin-5-ylamine,5-amine-4,6-dichloropyrimidine,5-amino-4,6-dichloropyfimidine,4,6-dichloro-pyrimidin-5-ylamine,pyrimidine, 5-amino-4,6-dichloro,4,6-dichloropyrimidine-5-ylamine PubChem CID: 79434 IUPAC Name: 4,6-dichloropyrimidin-5-amine SMILES: NC1=C(Cl)N=CN=C1Cl

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Specifications

PubChem CID	79434
CAS	5413-85-4
Molecular Weight (g/mol)	163.99
MDL Number	MFCD00006108
SMILES	NC1=C(Cl)N=CN=C1Cl
Synonym	5-amino-4,6-dichloropyrimidine,5-pyrimidinamine, 4,6-dichloro,4,6-dichloro-5-pyrimidinamine,4,6-dichloro-5-aminopyrimidine,4,6-dichloropyrimidin-5-ylamine,5-amine-4,6-dichloropyrimidine,5-amino-4,6-dichloropyfimidine,4,6-dichloro-pyrimidin-5-ylamine,pyrimidine, 5-amino-4,6-dichloro,4,6-dichloropyrimidine-5-ylamine
IUPAC Name	4,6-dichloropyrimidin-5-amine
InChI Key	NIGDWBHWHVHOAD-UHFFFAOYSA-N
Molecular Formula	C4H3Cl2N3

4-Amino-6-hydroxy-2-methylpyrimidine dihydrate, 98+%

CAS: 388582-41-0 Molecular Formula: C5H11N3O3 Molecular Weight (g/mol): 161.16 MDL Number: MFCD00150311 InChI Key: QJZWHXSXVBZLJI-UHFFFAOYSA-N Synonym: 4-amino-6-hydroxy-2-methylpyrimidine dihydrate,6-amino-2-methylpyrimidin-4-ol dihydrate,6-amino-2-methyl-1h-pyrimidin-4-one dihydrate,acmc-1adza,4 3h-pyrimidinone,6-amino-2-methyl-, hydrate 1:2,4-amino-6-hydroxy-2-methylpyrimidine dihydrate, 98+%,6-amino-2-methyl-3-hydropyrimidin-4-one, hydrate, hydrate PubChem CID: 2724727 IUPAC Name: 6-amino-2-methyl-1H-pyrimidin-4-one;dihydrate SMILES: O.O.CC1=NC(=O)C=C(N)N1

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Specifications

PubChem CID	2724727
CAS	388582-41-0
Molecular Weight (g/mol)	161.16
MDL Number	MFCD00150311
SMILES	O.O.CC1=NC(=O)C=C(N)N1
Synonym	4-amino-6-hydroxy-2-methylpyrimidine dihydrate,6-amino-2-methylpyrimidin-4-ol dihydrate,6-amino-2-methyl-1h-pyrimidin-4-one dihydrate,acmc-1adza,4 3h-pyrimidinone,6-amino-2-methyl-, hydrate 1:2,4-amino-6-hydroxy-2-methylpyrimidine dihydrate, 98+%,6-amino-2-methyl-3-hydropyrimidin-4-one, hydrate, hydrate
IUPAC Name	6-amino-2-methyl-1H-pyrimidin-4-one;dihydrate
InChI Key	QJZWHXSXVBZLJI-UHFFFAOYSA-N
Molecular Formula	C5H11N3O3

2,4,5-Triamino-6-hydroxypyrimidine sulfate, 94%

CAS: 35011-47-3 Molecular Formula: C4H9N5O5S Molecular Weight (g/mol): 239.206 MDL Number: MFCD00012785 InChI Key: RSKNEEODWFLVFF-UHFFFAOYSA-N Synonym: 2,4,5-triamino-6-hydroxypyrimidine sulfate,6-hydroxy-2,4,5-triaminopyrimidine sulfate,2,5,6-triaminopyrimidin-4 3h-one sulfate,unii-9sz7zx1h0l,sulfuric acid; triaminopyrimidin-4-ol,2,5,6-triamino-4-pyrimidinol sulfate,4 1h-pyrimidinone, 2,5,6-triamino-, sulfate,2,5,6-triaminopyrimidin-4 1h-one sulphate,2,5,6-triaminopyrimidin-4-ol sulfate,9sz7zx1h0l PubChem CID: 296856 IUPAC Name: sulfuric acid;2,5,6-triamino-1H-pyrimidin-4-one SMILES: C1(=C(NC(=NC1=O)N)N)N.OS(=O)(=O)O

Pricing and Availability
Specifications

PubChem CID	296856
CAS	35011-47-3
Molecular Weight (g/mol)	239.206
MDL Number	MFCD00012785
SMILES	C1(=C(NC(=NC1=O)N)N)N.OS(=O)(=O)O
Synonym	2,4,5-triamino-6-hydroxypyrimidine sulfate,6-hydroxy-2,4,5-triaminopyrimidine sulfate,2,5,6-triaminopyrimidin-4 3h-one sulfate,unii-9sz7zx1h0l,sulfuric acid; triaminopyrimidin-4-ol,2,5,6-triamino-4-pyrimidinol sulfate,4 1h-pyrimidinone, 2,5,6-triamino-, sulfate,2,5,6-triaminopyrimidin-4 1h-one sulphate,2,5,6-triaminopyrimidin-4-ol sulfate,9sz7zx1h0l
IUPAC Name	sulfuric acid;2,5,6-triamino-1H-pyrimidin-4-one
InChI Key	RSKNEEODWFLVFF-UHFFFAOYSA-N
Molecular Formula	C4H9N5O5S

2-Amino-4-hydroxy-6-methylpyrimidine, 98%

CAS: 3977-29-5 Molecular Formula: C5H7N3O Molecular Weight (g/mol): 125.131 MDL Number: MFCD00006095 InChI Key: KWXIPEYKZKIAKR-UHFFFAOYSA-N Synonym: 2-amino-4-hydroxy-6-methylpyrimidine,2-amino-6-methylpyrimidin-4-ol,6-methylisocytosine,mecytosine,2-amino-6-methylpyrimidin-4 3h-one,superacil,superacyl,4-methylisocytosine,2-amino-6-hydroxy-4-methylpyrimidine,2-amino-6-methyl-4-pyrimidinol PubChem CID: 1532 ChEBI: CHEBI:58959 IUPAC Name: 2-amino-6-methyl-1H-pyrimidin-4-one SMILES: CC1=CC(=O)N=C(N1)N

Pricing and Availability
Specifications

PubChem CID	1532
CAS	3977-29-5
Molecular Weight (g/mol)	125.131
ChEBI	CHEBI:58959
MDL Number	MFCD00006095
SMILES	CC1=CC(=O)N=C(N1)N
Synonym	2-amino-4-hydroxy-6-methylpyrimidine,2-amino-6-methylpyrimidin-4-ol,6-methylisocytosine,mecytosine,2-amino-6-methylpyrimidin-4 3h-one,superacil,superacyl,4-methylisocytosine,2-amino-6-hydroxy-4-methylpyrimidine,2-amino-6-methyl-4-pyrimidinol
IUPAC Name	2-amino-6-methyl-1H-pyrimidin-4-one
InChI Key	KWXIPEYKZKIAKR-UHFFFAOYSA-N
Molecular Formula	C5H7N3O

2,2'-Bipyrimidine, 96%

CAS: 34671-83-5 Molecular Formula: C8H6N4 Molecular Weight (g/mol): 158.16 MDL Number: MFCD00014600 InChI Key: HKOAFLAGUQUJQG-UHFFFAOYSA-N Synonym: 2,2'-bipyrimidine,2,2'-bipyrimidyl,2,2-bipyrimidine,bpym,2-pyrimidin-2-yl pyrimidine,bipyrimidine,2,2'-bipyrimidinyl,2,2'-dipyrimidyl,2,2;-bipyrimidine PubChem CID: 123444 SMILES: C1=CN=C(N=C1)C1=NC=CC=N1

Pricing and Availability
Specifications

PubChem CID	123444
CAS	34671-83-5
Molecular Weight (g/mol)	158.16
MDL Number	MFCD00014600
SMILES	C1=CN=C(N=C1)C1=NC=CC=N1
Synonym	2,2'-bipyrimidine,2,2'-bipyrimidyl,2,2-bipyrimidine,bpym,2-pyrimidin-2-yl pyrimidine,bipyrimidine,2,2'-bipyrimidinyl,2,2'-dipyrimidyl,2,2;-bipyrimidine
InChI Key	HKOAFLAGUQUJQG-UHFFFAOYSA-N
Molecular Formula	C8H6N4

4,6-Dichloropyrimidine, 97%

CAS: 1193-21-1 Molecular Formula: C4H2Cl2N2 Molecular Weight (g/mol): 148.97 MDL Number: MFCD00006109 InChI Key: XJPZKYIHCLDXST-UHFFFAOYSA-N Synonym: pyrimidine, 4,6-dichloro,4,6-dichloro-pyrimidine,4,6-dichloro pyrimidine,4,6-dichloro-1,3-diazine,4,6-dichlorpyrimidin,dichloropyrmidine,dichloropyrimidine,zlchem 225,pubchem6913,4,6-dichloropyrimdine PubChem CID: 70943 IUPAC Name: 4,6-dichloropyrimidine SMILES: ClC1=CC(Cl)=NC=N1

Pricing and Availability
Specifications

PubChem CID	70943
CAS	1193-21-1
Molecular Weight (g/mol)	148.97
MDL Number	MFCD00006109
SMILES	ClC1=CC(Cl)=NC=N1
Synonym	pyrimidine, 4,6-dichloro,4,6-dichloro-pyrimidine,4,6-dichloro pyrimidine,4,6-dichloro-1,3-diazine,4,6-dichlorpyrimidin,dichloropyrmidine,dichloropyrimidine,zlchem 225,pubchem6913,4,6-dichloropyrimdine
IUPAC Name	4,6-dichloropyrimidine
InChI Key	XJPZKYIHCLDXST-UHFFFAOYSA-N
Molecular Formula	C4H2Cl2N2

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