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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151 – 165 of 4,494 results

151

Thymine, 97%

CAS: 65-71-4 Molecular Formula: C5H6N2O2 Molecular Weight (g/mol): 126.115 MDL Number: MFCD00006026 InChI Key: RWQNBRDOKXIBIV-UHFFFAOYSA-N Synonym: thymine,5-methyluracil,thymin,2,4-dihydroxy-5-methylpyrimidine,thymine anhydrate,2,4 1h,3h-pyrimidinedione, 5-methyl,5-methylpyrimidine-2,4 1h,3h-dione,5-methyl-2,4 1h,3h-pyrimidinedione,thymin purine base,5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione PubChem CID: 1135 ChEBI: CHEBI:17821 IUPAC Name: 5-methyl-1H-pyrimidine-2,4-dione SMILES: CC1=CNC(=O)NC1=O

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Specifications

PubChem CID	1135
CAS	65-71-4
Molecular Weight (g/mol)	126.115
ChEBI	CHEBI:17821
MDL Number	MFCD00006026
SMILES	CC1=CNC(=O)NC1=O
Synonym	thymine,5-methyluracil,thymin,2,4-dihydroxy-5-methylpyrimidine,thymine anhydrate,2,4 1h,3h-pyrimidinedione, 5-methyl,5-methylpyrimidine-2,4 1h,3h-dione,5-methyl-2,4 1h,3h-pyrimidinedione,thymin purine base,5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
IUPAC Name	5-methyl-1H-pyrimidine-2,4-dione
InChI Key	RWQNBRDOKXIBIV-UHFFFAOYSA-N
Molecular Formula	C5H6N2O2

152

5-Bromouracil, 98+%

CAS: 51-20-7 Molecular Formula: C4H3BrN2O2 Molecular Weight (g/mol): 190.98 MDL Number: MFCD00006017 InChI Key: LQLQRFGHAALLLE-UHFFFAOYSA-N Synonym: 5-bromouracil,bromouracil,uracil, 5-bromo,5-bromopyrimidine-2,4 1h,3h-dione,5-bromo-2,4 1h,3h-pyrimidinedione,5-bromo-2,4-dihydroxypyrimidine,2,4 1h,3h-pyrimidinedione, 5-bromo,5-bromopyrimidine-2,4-diol,unii-4hk400g5uo,5-bromo-1,2,3,4-tetrahydropyrimidine-2,4-dione PubChem CID: 5802 ChEBI: CHEBI:20552 IUPAC Name: 5-bromo-1H-pyrimidine-2,4-dione SMILES: BrC1=CNC(=O)NC1=O

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Specifications

PubChem CID	5802
CAS	51-20-7
Molecular Weight (g/mol)	190.98
ChEBI	CHEBI:20552
MDL Number	MFCD00006017
SMILES	BrC1=CNC(=O)NC1=O
Synonym	5-bromouracil,bromouracil,uracil, 5-bromo,5-bromopyrimidine-2,4 1h,3h-dione,5-bromo-2,4 1h,3h-pyrimidinedione,5-bromo-2,4-dihydroxypyrimidine,2,4 1h,3h-pyrimidinedione, 5-bromo,5-bromopyrimidine-2,4-diol,unii-4hk400g5uo,5-bromo-1,2,3,4-tetrahydropyrimidine-2,4-dione
IUPAC Name	5-bromo-1H-pyrimidine-2,4-dione
InChI Key	LQLQRFGHAALLLE-UHFFFAOYSA-N
Molecular Formula	C4H3BrN2O2

153

6-chloropurine, 99+%

CAS: 87-42-3 Molecular Formula: C₅H₃ClN₄ Molecular Weight (g/mol): 154.56 MDL Number: MFCD00075825 InChI Key: ZKBQDFAWXLTYKS-UHFFFAOYSA-N Synonym: 6-chloropurine,6-chloro-9h-purine,1h-purine, 6-chloro,6-chloro-1h-purine,purine, 6-chloro,6-cp,6-chlorpurine,6-chloro purine,6-chloropurin,chloropurine, 6 PubChem CID: 5359277 IUPAC Name: 6-chloro-7H-purine SMILES: C1=NC2=C(N1)C(=NC=N2)Cl

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Specifications

PubChem CID	5359277
CAS	87-42-3
Molecular Weight (g/mol)	154.56
MDL Number	MFCD00075825
SMILES	C1=NC2=C(N1)C(=NC=N2)Cl
Synonym	6-chloropurine,6-chloro-9h-purine,1h-purine, 6-chloro,6-chloro-1h-purine,purine, 6-chloro,6-cp,6-chlorpurine,6-chloro purine,6-chloropurin,chloropurine, 6
IUPAC Name	6-chloro-7H-purine
InChI Key	ZKBQDFAWXLTYKS-UHFFFAOYSA-N
Molecular Formula	C₅H₃ClN₄

154

2-Mercaptopyrimidine, 98%

CAS: 1450-85-7 Molecular Formula: C4H4N2S Molecular Weight (g/mol): 112.15 MDL Number: MFCD00006073 InChI Key: HBCQSNAFLVXVAY-UHFFFAOYSA-N Synonym: 2-mercaptopyrimidine,pyrimidine-2-thiol,2-pyrimidinethiol,2-thiopyrimidine,pyrimidine-2 1h-thione,2 1h-pyrimidinethione,pyrimidinethione,2-pyrimidinethione,2-pyrimidinethiol 9ci,2-1h-pyrimidinthione PubChem CID: 1550489 ChEBI: CHEBI:53576 IUPAC Name: 1H-pyrimidine-2-thione SMILES: C1=CNC(=S)N=C1

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Specifications

PubChem CID	1550489
CAS	1450-85-7
Molecular Weight (g/mol)	112.15
ChEBI	CHEBI:53576
MDL Number	MFCD00006073
SMILES	C1=CNC(=S)N=C1
Synonym	2-mercaptopyrimidine,pyrimidine-2-thiol,2-pyrimidinethiol,2-thiopyrimidine,pyrimidine-2 1h-thione,2 1h-pyrimidinethione,pyrimidinethione,2-pyrimidinethione,2-pyrimidinethiol 9ci,2-1h-pyrimidinthione
IUPAC Name	1H-pyrimidine-2-thione
InChI Key	HBCQSNAFLVXVAY-UHFFFAOYSA-N
Molecular Formula	C4H4N2S

155

4-Amino-6-chloro-2-methylmercaptopyrimidine, 97%

CAS: 1005-38-5 Molecular Formula: C₅H₆ClN₃S Molecular Weight (g/mol): 175.64 MDL Number: MFCD00006088 InChI Key: ISUXMAHVLFRZQU-UHFFFAOYSA-N Synonym: 4-amino-6-chloro-2-methylthio pyrimidine,4-amino-6-chloro-2-methylmercaptopyrimidine,4-pyrimidinamine, 6-chloro-2-methylthio,6-chloro-2-methylsulfanyl pyrimidin-4-amine,6-chloro-2-methylthio pyrimidin-4-amine,pyrimidine, 4-amino-6-chloro-2-methylthio,4-amino-6-chloro-2-methylthiopyrimidine,6-chloro-2-methylthiopyrimidin-4-ylamine,6-amino-4-chloro-2-methylmercaptopyrimidine,6-chloro-2-methylsulfanyl-pyrimidin-4-amine PubChem CID: 70496 IUPAC Name: 6-chloro-2-methylsulfanylpyrimidin-4-amine SMILES: CSC1=NC(=CC(=N1)Cl)N

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Specifications

PubChem CID	70496
CAS	1005-38-5
Molecular Weight (g/mol)	175.64
MDL Number	MFCD00006088
SMILES	CSC1=NC(=CC(=N1)Cl)N
Synonym	4-amino-6-chloro-2-methylthio pyrimidine,4-amino-6-chloro-2-methylmercaptopyrimidine,4-pyrimidinamine, 6-chloro-2-methylthio,6-chloro-2-methylsulfanyl pyrimidin-4-amine,6-chloro-2-methylthio pyrimidin-4-amine,pyrimidine, 4-amino-6-chloro-2-methylthio,4-amino-6-chloro-2-methylthiopyrimidine,6-chloro-2-methylthiopyrimidin-4-ylamine,6-amino-4-chloro-2-methylmercaptopyrimidine,6-chloro-2-methylsulfanyl-pyrimidin-4-amine
IUPAC Name	6-chloro-2-methylsulfanylpyrimidin-4-amine
InChI Key	ISUXMAHVLFRZQU-UHFFFAOYSA-N
Molecular Formula	C₅H₆ClN₃S

156

4,6-Dihydroxypyrimidine, 98%

CAS: 1193-24-4 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.09 MDL Number: MFCD00016733 InChI Key: DUFGYCAXVIUXIP-UHFFFAOYSA-N Synonym: 4,6-dihydroxypyrimidine,pyrimidine-4,6-diol,4,6-pyrimidinediol,6-hydroxy-4 1h-pyrimidinone,4 1h-pyrimidinone, 6-hydroxy,4 3h-pyrimidinone, 6-hydroxy,6-hydroxypyrimidin-4 3h-one,6-hydroxy-1h-pyrimidin-4-one,4,6-dihydroxypyrimidin,6-hydroxy-4-pyrimidinone PubChem CID: 14512 SMILES: OC1=CC(=O)NC=N1

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Specifications

PubChem CID	14512
CAS	1193-24-4
Molecular Weight (g/mol)	112.09
MDL Number	MFCD00016733
SMILES	OC1=CC(=O)NC=N1
Synonym	4,6-dihydroxypyrimidine,pyrimidine-4,6-diol,4,6-pyrimidinediol,6-hydroxy-4 1h-pyrimidinone,4 1h-pyrimidinone, 6-hydroxy,4 3h-pyrimidinone, 6-hydroxy,6-hydroxypyrimidin-4 3h-one,6-hydroxy-1h-pyrimidin-4-one,4,6-dihydroxypyrimidin,6-hydroxy-4-pyrimidinone
InChI Key	DUFGYCAXVIUXIP-UHFFFAOYSA-N
Molecular Formula	C4H4N2O2

157

5-Bromo-2-methylpyrimidine, 98%

CAS: 7752-78-5 Molecular Formula: C5H5BrN2 Molecular Weight (g/mol): 173.013 MDL Number: MFCD07375143 InChI Key: NEDJTEXNSTUKHW-UHFFFAOYSA-N Synonym: 5-bromo-2-methyl-pyrimidine,2-methyl-5-bromopyrimidine,pyrimidine, 5-bromo-2-methyl,5-bromo-2-methyl-1,3-diazine,pubchem15231,acmc-1bm3h,5-bromo-2-methyl pyrimidine PubChem CID: 14387744 IUPAC Name: 5-bromo-2-methylpyrimidine SMILES: CC1=NC=C(C=N1)Br

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Specifications

PubChem CID	14387744
CAS	7752-78-5
Molecular Weight (g/mol)	173.013
MDL Number	MFCD07375143
SMILES	CC1=NC=C(C=N1)Br
Synonym	5-bromo-2-methyl-pyrimidine,2-methyl-5-bromopyrimidine,pyrimidine, 5-bromo-2-methyl,5-bromo-2-methyl-1,3-diazine,pubchem15231,acmc-1bm3h,5-bromo-2-methyl pyrimidine
IUPAC Name	5-bromo-2-methylpyrimidine
InChI Key	NEDJTEXNSTUKHW-UHFFFAOYSA-N
Molecular Formula	C5H5BrN2

158

4-Hydroxy-2-(trifluoromethyl)pyrimidine, 97%

CAS: 1546-80-1 Molecular Formula: C5H3F3N2O Molecular Weight (g/mol): 164.087 MDL Number: MFCD00151833 InChI Key: PDCVDVCPQWFGAX-UHFFFAOYSA-N Synonym: 2-trifluoromethyl pyrimidin-4-ol,4-hydroxy-2-trifluoromethyl pyrimidine,2-trifluoromethyl-1h-pyrimidin-6-one,2-trifluoromethyl-3h-pyrimidin-4-one,pubchem7199,acmc-1bux4,2-trifluoromethyl-pyrimidin-4-ol,2-trifluoromethyl-4-hydroxypyrimidine,4-hydroxy-2-trifluoromethylpyrimidine,4 3h-pyrimidinone,2-trifluoromethyl PubChem CID: 243570 IUPAC Name: 2-(trifluoromethyl)-1H-pyrimidin-6-one SMILES: C1=CN=C(NC1=O)C(F)(F)F

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Specifications

PubChem CID	243570
CAS	1546-80-1
Molecular Weight (g/mol)	164.087
MDL Number	MFCD00151833
SMILES	C1=CN=C(NC1=O)C(F)(F)F
Synonym	2-trifluoromethyl pyrimidin-4-ol,4-hydroxy-2-trifluoromethyl pyrimidine,2-trifluoromethyl-1h-pyrimidin-6-one,2-trifluoromethyl-3h-pyrimidin-4-one,pubchem7199,acmc-1bux4,2-trifluoromethyl-pyrimidin-4-ol,2-trifluoromethyl-4-hydroxypyrimidine,4-hydroxy-2-trifluoromethylpyrimidine,4 3h-pyrimidinone,2-trifluoromethyl
IUPAC Name	2-(trifluoromethyl)-1H-pyrimidin-6-one
InChI Key	PDCVDVCPQWFGAX-UHFFFAOYSA-N
Molecular Formula	C5H3F3N2O

159

5-Bromopyrimidine, 98%

CAS: 4595-59-9 Molecular Formula: C4H3BrN2 Molecular Weight (g/mol): 158.986 MDL Number: MFCD00006117 InChI Key: GYCPLYCTMDTEPU-UHFFFAOYSA-N Synonym: pyrimidine, 5-bromo,5-bromo pyrimidine,5-bromo-1,3-diazine,5-bromo-pyrimidine,5-brpy compound,5-brompyrimidin,5-brornopyrimidine,zlchem 349,pubchem6902,11-cis-retinyl-palmitate PubChem CID: 78344 IUPAC Name: 5-bromopyrimidine SMILES: C1=C(C=NC=N1)Br

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Specifications

PubChem CID	78344
CAS	4595-59-9
Molecular Weight (g/mol)	158.986
MDL Number	MFCD00006117
SMILES	C1=C(C=NC=N1)Br
Synonym	pyrimidine, 5-bromo,5-bromo pyrimidine,5-bromo-1,3-diazine,5-bromo-pyrimidine,5-brpy compound,5-brompyrimidin,5-brornopyrimidine,zlchem 349,pubchem6902,11-cis-retinyl-palmitate
IUPAC Name	5-bromopyrimidine
InChI Key	GYCPLYCTMDTEPU-UHFFFAOYSA-N
Molecular Formula	C4H3BrN2

160

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

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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

161

Isocytosine, 99%

CAS: 108-53-2 Molecular Formula: C4H5N3O Molecular Weight (g/mol): 111.10 MDL Number: MFCD00057557 MFCD00023256 InChI Key: XQCZBXHVTFVIFE-UHFFFAOYSA-N Synonym: isocytosine,2-amino-4-hydroxypyrimidine,2-aminopyrimidin-4-ol,2-aminopyrimidin-4 1h-one,2-amino-4-pyrimdinol,2-amino-4-pyrimidone,2-amino-4-oxypyrimidine,2-aminouracil,4-pyrimidinol, 2-amino,4 1h-pyrimidinone, 2-amino PubChem CID: 66950 ChEBI: CHEBI:55502 SMILES: NC1=NC=CC(=O)N1

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Specifications

PubChem CID	66950
CAS	108-53-2
Molecular Weight (g/mol)	111.10
ChEBI	CHEBI:55502
MDL Number	MFCD00057557 MFCD00023256
SMILES	NC1=NC=CC(=O)N1
Synonym	isocytosine,2-amino-4-hydroxypyrimidine,2-aminopyrimidin-4-ol,2-aminopyrimidin-4 1h-one,2-amino-4-pyrimdinol,2-amino-4-pyrimidone,2-amino-4-oxypyrimidine,2-aminouracil,4-pyrimidinol, 2-amino,4 1h-pyrimidinone, 2-amino
InChI Key	XQCZBXHVTFVIFE-UHFFFAOYSA-N
Molecular Formula	C4H5N3O

162

4-Chloro-6-methylpyrimidine, 97%

CAS: 3435-25-4 Molecular Formula: C5H5ClN2 Molecular Weight (g/mol): 128.559 MDL Number: MFCD02322991 InChI Key: MVAXKFAQKTWRAH-UHFFFAOYSA-N Synonym: 4-methyl-6-chloro pyrimidine,4-methyl-6-chloropyrimidine,pyrimidine, 4-chloro-6-methyl,4-chloro-6-methyl-pyrimidine,6-chloro-4-methylpyrimidine,4-chloro-6-methyl-1,3-diazine,pubchem13240,6-methyl-4-chloropyrimidin,ksc269g3h,pyrimidine, 4-chloro-6-methyl-6ci,7ci,8ci,9ci PubChem CID: 581796 IUPAC Name: 4-chloro-6-methylpyrimidine SMILES: CC1=CC(=NC=N1)Cl

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Specifications

PubChem CID	581796
CAS	3435-25-4
Molecular Weight (g/mol)	128.559
MDL Number	MFCD02322991
SMILES	CC1=CC(=NC=N1)Cl
Synonym	4-methyl-6-chloro pyrimidine,4-methyl-6-chloropyrimidine,pyrimidine, 4-chloro-6-methyl,4-chloro-6-methyl-pyrimidine,6-chloro-4-methylpyrimidine,4-chloro-6-methyl-1,3-diazine,pubchem13240,6-methyl-4-chloropyrimidin,ksc269g3h,pyrimidine, 4-chloro-6-methyl-6ci,7ci,8ci,9ci
IUPAC Name	4-chloro-6-methylpyrimidine
InChI Key	MVAXKFAQKTWRAH-UHFFFAOYSA-N
Molecular Formula	C5H5ClN2

163

6-chloro-7-deazapurine, 97%

CAS: 3680-69-1 Molecular Formula: C₆H₄ClN₃ Molecular Weight (g/mol): 153.57 InChI Key: BPTCCCTWWAUJRK-UHFFFAOYSA-N Synonym: 4-chloro-7h-pyrrolo 2,3-d pyrimidine,4-chloropyrrolo 2,3-d pyrimidine,6-chloro-7-deazapurine,4-chloro-1h-pyrrolo 2,3-d pyrimidine,7h-pyrrolo 2,3-d pyrimidine, 4-chloro,1h-pyrrolo 2,3-d pyrimidine, 4-chloro,6-chloro-7-deazapurine 4-chloro-1h-pyrrolo 2,3-d pyrimidine,4-chloro-1h-pyrrol 2,3-d pyrimidine PubChem CID: 5356682 IUPAC Name: 4-chloro-7H-pyrrolo[2,3-d]pyrimidine SMILES: C1=CNC2=C1C(=NC=N2)Cl

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Specifications

PubChem CID	5356682
CAS	3680-69-1
Molecular Weight (g/mol)	153.57
SMILES	C1=CNC2=C1C(=NC=N2)Cl
Synonym	4-chloro-7h-pyrrolo 2,3-d pyrimidine,4-chloropyrrolo 2,3-d pyrimidine,6-chloro-7-deazapurine,4-chloro-1h-pyrrolo 2,3-d pyrimidine,7h-pyrrolo 2,3-d pyrimidine, 4-chloro,1h-pyrrolo 2,3-d pyrimidine, 4-chloro,6-chloro-7-deazapurine 4-chloro-1h-pyrrolo 2,3-d pyrimidine,4-chloro-1h-pyrrol 2,3-d pyrimidine
IUPAC Name	4-chloro-7H-pyrrolo[2,3-d]pyrimidine
InChI Key	BPTCCCTWWAUJRK-UHFFFAOYSA-N
Molecular Formula	C₆H₄ClN₃

164

4-Amino-5-bromopyrimidine, 98%

CAS: 1439-10-7 Molecular Formula: C4H4BrN3 Molecular Weight (g/mol): 174.001 MDL Number: MFCD00233962 InChI Key: IIFAONYUCDAVGA-UHFFFAOYSA-N PubChem CID: 10261576 IUPAC Name: 5-bromopyrimidin-4-amine SMILES: C1=C(C(=NC=N1)N)Br

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Specifications

PubChem CID	10261576
CAS	1439-10-7
Molecular Weight (g/mol)	174.001
MDL Number	MFCD00233962
SMILES	C1=C(C(=NC=N1)N)Br
IUPAC Name	5-bromopyrimidin-4-amine
InChI Key	IIFAONYUCDAVGA-UHFFFAOYSA-N
Molecular Formula	C4H4BrN3

165

2-chloropyrimidine-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 149849-92-3 Molecular Formula: C5H3ClN2O2 Molecular Weight (g/mol): 158.541 MDL Number: MFCD06739041 InChI Key: YMDSUQSBJRDYLI-UHFFFAOYSA-N Synonym: 2-chloropyrimidine-4-carboxylicacid,4-pyrimidinecarboxylic acid, 2-chloro,4-carboxy-2-chloropyrimidine,2-chloro-pyrimidine-4-carboxylic acid,2-chloro-4-pyrimidinecarboxylic acid,pubchem21879,acmc-209d3c,ksc497g7f,2-chloropyrimidin-4-carboxylic acid,2-chloro-pyrimidine-4-carboxylicacid PubChem CID: 22135751 IUPAC Name: 2-chloropyrimidine-4-carboxylic acid SMILES: C1=CN=C(N=C1C(=O)O)Cl

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Specifications

PubChem CID	22135751
CAS	149849-92-3
Molecular Weight (g/mol)	158.541
MDL Number	MFCD06739041
SMILES	C1=CN=C(N=C1C(=O)O)Cl
Synonym	2-chloropyrimidine-4-carboxylicacid,4-pyrimidinecarboxylic acid, 2-chloro,4-carboxy-2-chloropyrimidine,2-chloro-pyrimidine-4-carboxylic acid,2-chloro-4-pyrimidinecarboxylic acid,pubchem21879,acmc-209d3c,ksc497g7f,2-chloropyrimidin-4-carboxylic acid,2-chloro-pyrimidine-4-carboxylicacid
IUPAC Name	2-chloropyrimidine-4-carboxylic acid
InChI Key	YMDSUQSBJRDYLI-UHFFFAOYSA-N
Molecular Formula	C5H3ClN2O2

Pyrimidines And Derivatives

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