AG00CIYG

3154-99-2 | 2-Cyclopropylbenzonitrile

AG00CIYG

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CAS Number	3154-99-2
Catalog Number	AG00CIYG(AGN-PC-0WC7XX)
Chemical Name	2-Cyclopropylbenzonitrile
IUPAC Name	2-cyclopropylbenzonitrile
InChI	InChI=1S/C10H9N/c11-7-9-3-1-2-4-10(9)8-5-6-8/h1-4,8H,5-6H2
InChI Key	ZQDBFODKGYNZFK-UHFFFAOYSA-N
MDL Number	MFCD00463731
Molecular Formula	C10H9N
Molecular Weight	143.1852
SMILES	N#CC1=CC=CC=C1C2CC2
Synonyms	2-Cyclopropylbenzonitrile, 3154-99-2, o-cyanophenylcyclopropane, 2-cyclopropylbenzenecarbonitrile, SCHEMBL3167985, CTK7C8678, DTXSID30553211, MFCD00463731, SBB086290, ZINC17939992, AKOS006274997, RL03114, AJ-70184, AS-35689, SC-36905, AB0073644, FT-0684457, X-1806, J-509259, I01-13503,

Complexity	184
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	143.073g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	143.189g/mol
Monoisotopic Mass	143.073g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	23.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301+H311+H331
Packing Group	Ⅲ
Precautionary statements	P261-P280-P301+P310-P311
UN Code	UN 3276

Certificate of Analysis

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