AG00G3DR

7584-05-6 | 4-Cyano-3-methylpyridine

AG00G3DR

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CAS Number	7584-05-6
Catalog Number	AG00G3DR(AGN-PC-0JLTNV)
Chemical Name	4-Cyano-3-methylpyridine
EC Number	231-491-1
IUPAC Name	3-methylpyridine-4-carbonitrile
InChI	InChI=1S/C7H6N2/c1-6-5-9-3-2-7(6)4-8/h2-3,5H,1H3
InChI Key	SFNWPKSTEHBXSY-UHFFFAOYSA-N
MDL Number	MFCD09261048
Molecular Formula	C7H6N2
Molecular Weight	118.1359
SMILES	CC1=C(C=CN=C1)C#N
Synonyms	3-Methylisonicotinonitrile, 7584-05-6, 4-Cyano-3-methylpyridine, 3-methylpyridine-4-carbonitrile, 3-Methyl-4-pyridinecarbonitrile, 3-METHYL-4-CYANOPYRIDINE, 4-Pyridinecarbonitrile,3-methyl-, 3-METHYL-ISONICOTINONITRILE, 4-PYRIDINECARBONITRILE, 3-METHYL-, PubChem20005, PubChem23127, AC1Q2OIH, AC1Q2RGC, 4-Cyano-3-methyl-pyridine, AN-584/42118740, SCHEMBL342957, AC1L32O6, CTK5E2075, KS-00001AYG, DTXSID50226733, SFNWPKSTEHBXSY-UHFFFAOYSA-N, ZINC5420335, EINECS 231-491-1, ANW-59891, CC0237, MFCD09261048, AKOS015842250, GS-5496, PB23623, QC-6564, RP00634, AJ-54002, AK-32547, AM804327, EN000216, SC-48878, DB-081958, TR-024347, 4CH-004540, CS-0037320, FT-0696005, ST24042349, Y6643, Q-1382, W-204311, F8881-5702, C7H6N2, CID82063, AR-1F4492, ACN-028413, 4846-01-9,

Complexity	133
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	118.053g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	118.139g/mol
Monoisotopic Mass	118.053g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	36.7A^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	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

Lot Number