AG00C09G

38275-56-8 | 2-Pyrimidinecarbonitrile, 5-chloro- (9CI)

AG00C09G

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CAS Number	38275-56-8
Catalog Number	AG00C09G(AGN-PC-0JWJLY)
Chemical Name	2-Pyrimidinecarbonitrile, 5-chloro- (9CI)
IUPAC Name	5-chloropyrimidine-2-carbonitrile
InChI	InChI=1S/C5H2ClN3/c6-4-2-8-5(1-7)9-3-4/h2-3H
InChI Key	XCZYVEHAGNDPGY-UHFFFAOYSA-N
MDL Number	MFCD03001466
Molecular Formula	C5H2ClN3
Molecular Weight	139.5425
SMILES	ClC1=CN=C(N=C1)C#N
Synonyms	5-chloropyrimidine-2-carbonitrile, 38275-56-8, 2-Cyano-5-chloropyrimidine, 2-Pyrimidinecarbonitrile, 5-chloro- (9CI), MFCD03001466, 2-Pyrimidinecarbonitrile,5-chloro-, 5-Chloropyrimidine-2-carbonitrile?, PubChem18415, AC1LGF0D, AC1Q3PNO, KSC497M1D, SCHEMBL3456377, Jsp006707, CTK3J7611, DTXSID20356172, XCZYVEHAGNDPGY-UHFFFAOYSA-N, ZINC336445, 5-CHLORO-2-CYANOPYRIMIDINE, ACT01520, EBD51409, AC-874, ANW-49790, AKOS000320042, AB12835, CC-1309, CM14285, CS-W002980, QC-5659, RP20558, RTC-020705, AJ-19779, AK-32272, AM803819, BC228065, BR-32272, DS-12048, SC-47978, SY012231, AB0061551, ST2418749, TC-020705, 4CH-015326, FT-0603726, KS-00000471, MFCD03001466 (95%), S-6099, 275C568, I03-0121, J-517415, AR-1G7883, CID820198, ZINC00336445, ACN-049594, 38550-46-8,

Complexity	130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	138.994g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	139.542g/mol
Monoisotopic Mass	138.994g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	49.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number