AG002N31

23395-72-4 | quinoline-6-carbonitrile

AG002N31

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CAS Number	23395-72-4
Catalog Number	AG002N31(AGN-PC-0JTG8D)
Chemical Name	quinoline-6-carbonitrile
IUPAC Name	quinoline-6-carbonitrile
InChI	InChI=1S/C10H6N2/c11-7-8-3-4-10-9(6-8)2-1-5-12-10/h1-6H
InChI Key	NIFLNJLWZZABMI-UHFFFAOYSA-N
MDL Number	MFCD09999543
Molecular Formula	C10H6N2
Molecular Weight	154.1680
SMILES	N1=CC=CC2=CC(=CC=C12)C#N
Synonyms	quinoline-6-carbonitrile, 23395-72-4, 6-Cyanoquinoline, 6-Quinolinecarbonitrile, NIFLNJLWZZABMI-UHFFFAOYSA-N, 6-Cyano quinoline, ACMC-1CIDB, 6-Quinolinecarbonitrile #, AC1Q4R4A, SCHEMBL506632, AC1LC232, CTK4F1400, DTXSID60343900, KS-00000E2K, ANW-25113, MFCD09999543, quinoline-6-carbonitrile, AldrichCPR, ZINC32192127, AKOS005256934, FS-2824, RP21851, TRA0012416, AJ-84963, AK-25091, BR-25091, CJ-17918, SC-42357, SY024166, AB0023618, ST2413771, TR-010870, 4CH-013910, CS-0019004, FT-0647923, W4713, EN300-42062, S-6235, MFCD09999543 (97+%), J-524196, C10H6N2, CID592995, ACN-027404,

Complexity	203
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	154.053g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	154.172g/mol
Monoisotopic Mass	154.053g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	36.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H332-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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