AG003F0Y

52583-90-1 | 2-(Cyclopropylamino)nicotinonitrile

AG003F0Y

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CAS Number	52583-90-1
Catalog Number	AG003F0Y(AGN-PC-00AN1C)
Chemical Name	2-(Cyclopropylamino)nicotinonitrile
IUPAC Name	2-(cyclopropylamino)pyridine-3-carbonitrile
InChI	InChI=1S/C9H9N3/c10-6-7-2-1-5-11-9(7)12-8-3-4-8/h1-2,5,8H,3-4H2,(H,11,12)
InChI Key	NQVWMXLKPISDFN-UHFFFAOYSA-N
MDL Number	MFCD09455268
Molecular Formula	C9H9N3
Molecular Weight	159.1879
SMILES	N#CC1=C(NC2CC2)N=CC=C1
Synonyms	2-(cyclopropylamino)nicotinonitrile, 52583-90-1, 2-Cyclopropylamino-nicotinonitrile, 2-(cyclopropylamino)pyridine-3-carbonitrile, ACMC-209l0c, SCHEMBL4535545, CTK4J6135, DTXSID60467817, NQVWMXLKPISDFN-UHFFFAOYSA-N, ALBB-004809, ANW-31498, BBL012472, MFCD09455268, STK501320, ZINC19476584, AKOS000180476, MCULE-4910103401, AJ-73645, AM100909, CJ-16161, 2-(cyclopropylamino)-3-pyridinecarbonitrile, ST2404024, TR-036977, 4CH-018359, V6395, K-9587, AB01005472-01, C9H9N3, CID11513793,

Complexity	201
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	159.08g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	159.192g/mol
Monoisotopic Mass	159.08g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	48.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P260-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number