2-Chloro-5-methylpyrimidine - CAS 22536-61-4

Name: 2-Chloro-5-methylpyrimidine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB017654
Product Name:	2-Chloro-5-methylpyrimidine
CAS:	22536-61-4
Synonyms:	2-chloro-5-methylpyrimidine; 2-chloro-5-methylpyrimidine

Technical Data

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Patents

Computed Properties

IUPAC Name:	2-chloro-5-methylpyrimidine
Description:	2-Chloro-5-methylpyrimidine (CAS# 22536-61-4) is a useful research chemical.
Molecular Weight:	128.56
Molecular Formula:	C5H5ClN2
Canonical SMILES:	CC1=CN=C(N=C1)Cl
InChI:	InChI=1S/C5H5ClN2/c1-4-2-7-5(6)8-3-4/h2-3H,1H3
InChI Key:	APRMCBSTMFKLEI-UHFFFAOYSA-N
Boiling Point:	239.2 °C at 760 mmHg
Purity:	97.0 %
Density:	1.234 g/cm³
MDL:	MFCD09260903
LogP:	1.43840

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Related Functional Groups

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GHS Hazard Statement:	H302 (75%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-113480522-A	Novel phenylpyrazole derivative and application thereof in hypoglycemic drugs	20210819
CN-113512004-A	Synthetic method of 2-fluoro-5-trifluoromethylpyrimidine	20210722
CN-111995583-A	Synthesis method of 1, 5-dimethylpyrimidine-2 (1H) -ketone	20200818
KR-102178181-B1	Novel hydrazone derivatives comprising aryl or heteroaryl group substituted at terminal amine and use thereof	20200331
KR-20200076655-A	Novel hydrazone derivatives comprising aryl or heteroaryl group substituted at terminal amine and use thereof	20200331

Complexity:	68.8
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	128.0141259
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	128.0141259
Rotatable Bond Count:	0
Topological Polar Surface Area:	25.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5