AG00DAO8

51957-32-5 | 4-Chloro-5-methylpyrimidine

AG00DAO8

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CAS Number	51957-32-5
Catalog Number	AG00DAO8(AGN-PC-00L0YK)
Chemical Name	4-Chloro-5-methylpyrimidine
IUPAC Name	4-chloro-5-methylpyrimidine
InChI	InChI=1S/C5H5ClN2/c1-4-2-7-3-8-5(4)6/h2-3H,1H3
InChI Key	RPDVPWWBNQKLAS-UHFFFAOYSA-N
MDL Number	MFCD08236809
Molecular Formula	C5H5ClN2
Molecular Weight	128.5596
SMILES	ClC1=NC=NC=C1C
Synonyms	4-Chloro-5-methylpyrimidine, 51957-32-5, 4-Chloro-5-methyl-pyrimidine, PubChem21457, 4-Chloro-5-methyl pyrimidine, SCHEMBL859279, CTK3J4053, Pyrimidine, 4-chloro-5-methyl-, DTXSID30520125, RPDVPWWBNQKLAS-UHFFFAOYSA-N, KS-00000L4M, ANW-51160, BBL102388, CC-895, MFCD08236809, STL556190, ZINC14982420, AKOS006285522, AB44072, CS-W004974, GS-6586, LS20953, RP19821, RTR-018488, AC-26628, AJ-65665, AK-25152, AM803988, AN-41087, BR-25152, CJ-14693, HC210346, QC-11346, SC-47959, AB0025251, DB-081932, ST2411318, TL8003438, TR-018488, 4CH-001400, FT-0649216, W6679, S-6207, 957C325, I03-0509, W-202961, C5H5ClN2, ACN-052518, A7646, Pyrimidine, 4-chloro-5-methyl- (6CI,9CI),

Complexity	76.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	128.014g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	128.559g/mol
Monoisotopic Mass	128.014g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	25.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H332-H335
Packing Group	\N
Precautionary statements	P261-P280-P305+P351+P338
UN Code	\N

Certificate of Analysis

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