2-(Chloromethyl)pyrimidine Hydrochloride - CAS 936643-80-0

Catalog:	BB041009
Product Name:	2-(Chloromethyl)pyrimidine Hydrochloride
CAS:	936643-80-0
Synonyms:	2-(chloromethyl)pyrimidine;hydrochloride; 2-(chloromethyl)pyrimidine;hydrochloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-(chloromethyl)pyrimidine;hydrochloride
Description:	2-(Chloromethyl)pyrimidine Hydrochloride (CAS# 936643-80-0) is a useful research chemical.
Molecular Weight:	165.02
Molecular Formula:	C5H6Cl2N2
Canonical SMILES:	C1=CN=C(N=C1)CCl.Cl
InChI:	InChI=1S/C5H5ClN2.ClH/c6-4-5-7-2-1-3-8-5;/h1-3H,4H2;1H
InChI Key:	XLGVMJXAZRCTRU-UHFFFAOYSA-N
Storage:	Inert atmosphere, 2-8 °C
MDL:	MFCD09834372
LogP:	2.01740

Publication Number	Title	Priority Date
CN-113372335-A	Phenylalanine derivative containing 1,2, 4-triazole thioether and preparation method and application thereof	20210705
WO-2021112251-A1	Azetidine sulfonamide compound	20191206
WO-2021050059-A1	Dna-pk inhibiting compounds	20190911
WO-2020249785-A1	Substituted heteroaromatic pyrazolo-pyridines and their use as glun2b receptor modulators	20190614
US-2021017169-A1	Substituted heteroaromatic pyrazolo-pyridines and their use as glun2b receptor modulators	20190614

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Related Functional Groups

Other Pyrimidines

[13566-71-7]
4(3H)-Pyrimidinone,6-hydroxy-2-phenyl-
[927800-47-3]
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[551-62-2]
1,2,3,4-Tetrafluorobenzene
[1489-53-8]
1,2,3-Trifluorobenzene
[1192570-20-9]
2-Morpholino-2-(2-(trifluoromethyl)pyrimidin-5-yl)ethanamine
[667-27-6]
Ethyl bromodifluoroacetate

GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	61.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	163.9908036
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	163.9908036
Rotatable Bond Count:	1
Topological Polar Surface Area:	25.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0