AG0000KS

1000343-22-5 | 1H-Indole-5-carbonitrile, 6-methyl-

AG0000KS

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CAS Number	1000343-22-5
Catalog Number	AG0000KS(AGN-PC-0WCJBL)
Chemical Name	1H-Indole-5-carbonitrile, 6-methyl-
IUPAC Name	6-methyl-1H-indole-5-carbonitrile
InChI	InChI=1S/C10H8N2/c1-7-4-10-8(2-3-12-10)5-9(7)6-11/h2-5,12H,1H3
InChI Key	RKHWDANYXRMLOW-UHFFFAOYSA-N
MDL Number	MFCD09026973
Molecular Formula	C10H8N2
Molecular Weight	156.1839
SMILES	N#CC1=CC2=C(NC=C2)C=C1C
Synonyms	5-Cyano-6-methyl indole, 1000343-22-5, 6-Methyl-1H-indole-5-carbonitrile, 5-Cyano-6-methylindole, 1H-Indole-5-carbonitrile, 6-methyl-, SCHEMBL12803944, DTXSID70646651, RKHWDANYXRMLOW-UHFFFAOYSA-N, CC-783, FCH863565, MFCD09026973, ZINC14985755, AKOS006289793, KS-000006F7, AJ-66419, AK141027, AS-34223, BC600089, AB0046981, AX8281232, 4CH-000040, CS-0050503, ST24045474, W-1174, ACN-027455, 3-(TRIFLUOROMETHYL)-5,6,7,8-TETRAHYDRO-5-METHYL-[1,2,4]TRIAZOLO[4,3-A]PYRAZINE,

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	1
Isotope Atom Count	0
Molecular Weight	156.188g/mol
Monoisotopic Mass	156.069g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	39.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

Lot Number