AG00BC7S

20996-87-6 | 1-Methyl-1H-indole-6-carbonitrile

AG00BC7S

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CAS Number	20996-87-6
Catalog Number	AG00BC7S(AGN-PC-00P2QA)
Chemical Name	1-Methyl-1H-indole-6-carbonitrile
IUPAC Name	1-methylindole-6-carbonitrile
InChI	InChI=1S/C10H8N2/c1-12-5-4-9-3-2-8(7-11)6-10(9)12/h2-6H,1H3
InChI Key	FOGAAHLMYPQCJG-UHFFFAOYSA-N
MDL Number	MFCD08690254
Molecular Formula	C10H8N2
Molecular Weight	156.1839
SMILES	N#CC1=CC2=C(C=C1)C=CN2C
Synonyms	1-Methyl-1H-indole-6-carbonitrile, 20996-87-6, 1-Methylindole-6-carbonitrile, MFCD08690254, 1H-Indole-6-carbonitrile, 1-methyl-, 6-cyano-1-methylindole, ACMC-1CIRG, 1-Methyl-6-cyanoindole, 6-cyano-1-methyl-1H-indole, SCHEMBL506374, CTK8B1176, DTXSID90572246, FOGAAHLMYPQCJG-UHFFFAOYSA-N, ALBB-010774, KS-00003HA9, ANW-24305, ZINC12370288, AKOS005172569, AS-8182, MCULE-5669954709, RP01912, AJ-61790, AK-92483, CJ-13978, DB-066398, TC-113050, FT-0683315, ST24027117, Y8217, B-7827, I10-1185, W-206582, C10H8N2, ACN-038736, 1H-Indole-6-carbonitrile, 1-methyl- (9CI),

Complexity	215
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	156.069g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	156.188g/mol
Monoisotopic Mass	156.069g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	28.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number