AG003KPF

170230-87-2 | 4-Amino-3-ethylbenzonitrile

AG003KPF

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CAS Number	170230-87-2
Catalog Number	AG003KPF(AGN-PC-0KK70X)
Chemical Name	4-Amino-3-ethylbenzonitrile
IUPAC Name	4-amino-3-ethylbenzonitrile
InChI	InChI=1S/C9H10N2/c1-2-8-5-7(6-10)3-4-9(8)11/h3-5H,2,11H2,1H3
InChI Key	YOHLABDNVQLZIA-UHFFFAOYSA-N
MDL Number	MFCD00041431
Molecular Formula	C9H10N2
Molecular Weight	146.1891
SMILES	N#CC1=CC=C(N)C(CC)=C1
Synonyms	4-Amino-3-ethylbenzonitrile, 170230-87-2, 4-Amino-3-ethyl-benzonitrile, 4-Cyano-2-ethylaniline, 4-Amino-3-ethyl benzonitrile, BUTTPARK 13\03-08, YOHLABDNVQLZIA-UHFFFAOYSA-N, MFCD00041431, 4-amino-3-ethylbenzenecarbonitrile, benzonitrile, 4-amino-3-ethyl- (9ci), PubChem16098, PubChem21039, ACMC-209xcd, Intermediates-ZCF02269, 4-amino-3-ethylbenzontrile, AC1MC32M, AC1Q2T7W, 3-ethyl-4-aminobenzonitrile, SCHEMBL398911, Benzonitrile,4-amino-3-ethyl-, Benzonitrile, 4-amino-3-ethyl-, CTK4D3524, DTXSID30370682, ACT00962, KS-00000MM4, ZINC4240228, 4-azanyl-3-ethyl-benzenecarbonitrile, ANW-47483, SBB086499, AKOS006230026, AC-5204, AS05780, CM12916, CS-W008227, DS-1636, LS10564, MCULE-3893404177, RTC-030089, TRA0061783, VZ28234, 4-Amino-3-ethylbenzonitrile, AldrichCPR, AJ-49256, AK-33651, AN-11225, BR-33651, CJ-11639, SC-13917, AB0022778, DB-006637, ST2411086, TC-030089, 4CH-014791, FT-0082451, FT-0601004, ST50824028, W3710, S-3408, 230A872, A811180, I01-8178, C9H10N2, ZINC04240228, CID2735330, 4-(2-Methyl-1H-imidazol-1-yl)-2,2-diphenylbutanamide,

Complexity	168
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	1
Topological Polar Surface Area	49.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302
Packing Group	Ⅲ
Precautionary statements	P280-P309-P310
UN Code	UN 3439

Certificate of Analysis

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