AG00I9CU

52313-35-6 | 2-Quinolinecarbonitrile, 6-chloro-

AG00I9CU

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CAS Number	52313-35-6
Catalog Number	AG00I9CU(AGN-PC-02T4XI)
Chemical Name	2-Quinolinecarbonitrile, 6-chloro-
IUPAC Name	6-chloroquinoline-2-carbonitrile
InChI	InChI=1S/C10H5ClN2/c11-8-2-4-10-7(5-8)1-3-9(6-12)13-10/h1-5H
InChI Key	HUEJYSXRUMFXCZ-UHFFFAOYSA-N
MDL Number	MFCD17926278
Molecular Formula	C10H5ClN2
Molecular Weight	188.6131
SMILES	ClC1=CC2=C(C=C1)N=C(C=C2)C#N
Synonyms	6-Chloroquinoline-2-carbonitrile, 52313-35-6, 6-CHLORO-2-CYANO-QUINOLINE, 6-chloro-2-quinolinecarbonitrile, 2-Quinolinecarbonitrile, 6-chloro-, SCHEMBL743391, CTK1G2918, DTXSID10601466, HUEJYSXRUMFXCZ-UHFFFAOYSA-N, 7368AB, ANW-64968, MFCD17926278, ZINC62567441, AS-35583, AB0006706, AJ-114159, TC-153713, FT-0762818, X-1882, C10H5ClN2,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.014g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	188.614g/mol
Monoisotopic Mass	188.014g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	36.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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