AG0071LN

4714-63-0 | 4-(ethylaminomethyl)benzonitrile

AG0071LN

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CAS Number	4714-63-0
Catalog Number	AG0071LN(AGN-PC-040T46)
Chemical Name	4-(ethylaminomethyl)benzonitrile
IUPAC Name	4-(ethylamino)benzonitrile
InChI	InChI=1S/C9H10N2/c1-2-11-9-5-3-8(7-10)4-6-9/h3-6,11H,2H2,1H3
InChI Key	SDEKOWFEFINMCS-UHFFFAOYSA-N
MDL Number	MFCD09759029
Molecular Formula	C9H10N2
Molecular Weight	146.1891
SMILES	N#CC1=CC=C(NCC)C=C1
Synonyms	4-(Ethylamino)benzonitrile, 4714-63-0, Benzonitrile, 4-(ethylamino)-, 4-[Ethylamino]benzonitrile, 4-Ethylaminobenzonitrile, ACMC-209k88, SCHEMBL1800038, CTK8B1724, DTXSID60632629, SDEKOWFEFINMCS-UHFFFAOYSA-N, ANW-30486, MFCD11135503, ZINC19867430, AKOS000218511, 4-(ethylamino)benzonitrile, AldrichCPR, FS-4665, MCULE-1194016043, AJ-75528, AK-92693, CJ-16461, DB-000203, TR-017472, FT-0712118, ST24023219, V6077, EN300-40244, K-9107, 714E630, I01-7384, Naphthol AS-VL, C9H10N2,

Complexity	148
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	146.084g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	146.193g/mol
Monoisotopic Mass	146.084g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	35.8A^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-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number