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Methyl 4,6-Dichloropyrimidine-5-carboxylate

Methyl 4,6-Dichloropyrimidine-5-carboxylate - CAS 87600-71-3

Catalog:	BB038540
Product Name:	Methyl 4,6-Dichloropyrimidine-5-carboxylate
CAS:	87600-71-3
Synonyms:	4,6-dichloro-5-pyrimidinecarboxylic acid methyl ester; methyl 4,6-dichloropyrimidine-5-carboxylate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	methyl 4,6-dichloropyrimidine-5-carboxylate
Description:	Methyl 4,6-Dichloropyrimidine-5-carboxylate (CAS# 87600-71-3) is a useful research chemical.
Molecular Weight:	207.01
Molecular Formula:	C6H4Cl2N2O2
Canonical SMILES:	COC(=O)C1=C(N=CN=C1Cl)Cl
InChI:	InChI=1S/C6H4Cl2N2O2/c1-12-6(11)3-4(7)9-2-10-5(3)8/h2H,1H3
InChI Key:	XPIOIPGYUJMJKX-UHFFFAOYSA-N
MDL:	MFCD10698883
LogP:	1.57000

Publication Number	Title	Priority Date
TW-201802081-A	Compounds and their use in reducing uric acid levels (1)	20160630
US-2020017477-A1	Compounds and Their Use for Reducing Uric Acid Levels	20160630
WO-2018005192-A1	Compounds and their use for reducing uric acid levels	20160630
WO-2018005192-A9	Compounds and their use for reducing uric acid levels	20160630
US-10759784-B2	Compounds and their use for reducing uric acid levels	20160630

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[1427004-19-0]
DBCO-PEG4-NHS ester
[17746-05-3]
Undecanoyl chloride
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[59855-96-8]
2-(Methoxymethyl)thiazole-5-carboxylic Acid

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	169
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	205.9649828
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	205.9649828
Rotatable Bond Count:	2
Topological Polar Surface Area:	52.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2