AG0061V0

718-71-8 | Ethyl 2-cyano-2-phenylbutanoate

AG0061V0

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	718-71-8
Catalog Number	AG0061V0(AGN-PC-0TZI06)
Chemical Name	Ethyl 2-cyano-2-phenylbutanoate
IUPAC Name	ethyl 2-cyano-2-phenylbutanoate
InChI	InChI=1S/C13H15NO2/c1-3-13(10-14,12(15)16-4-2)11-8-6-5-7-9-11/h5-9H,3-4H2,1-2H3
InChI Key	VCJAUIYSQAXNGB-UHFFFAOYSA-N
MDL Number	MFCD00068977
Molecular Formula	C13H15NO2
Molecular Weight	217.2637
NSC Number	69121
SMILES	CCC(C1=CC=CC=C1)(C#N)C(OCC)=O
Synonyms	ethyl 2-cyano-2-phenylbutanoate, 718-71-8, Ethyl-2-phenyl-2-cyanobutylate, Ethylphenylcyano-acetic acid ethyl ester, ETHYL CYANOETHYLPHENYLACETATE, NSC69121, (R,S)-2-Cyano-2-phenyl-butyric acid ethyl ester, EC 700-275-3, AC1Q4QJ6, ethyl ethylphenylcyanoacetate, NCIOpen2_003448, AC1L5H03, SCHEMBL9214363, CTK5D5184, DTXSID60290526, EBD8174, VCJAUIYSQAXNGB-UHFFFAOYSA-N, ALBB-025775, KS-00000G7X, NSC 6912, ZX-AN024288, ANW-45800, MFCD00068977, NSC-69121, SBB065121, AKOS015890653, ethyl 2-cyano-2-ethyl-2-phenylacetate, MCULE-1317963598, AK-87629, BC225260, CC-28299, DS-18350, P476, 2-Cyano-2-phenylbutanoic acid ethyl ester, 2-Cyano-2-phenyl-butyric Acid Ethyl Ester, AX8129336, TC-134545, FT-0656881, R1946, ST24030508, ST45028921, 2-Phenyl-2-ethyl-2-cyanoacetic acid ethyl ester, 718E718, C-28075, Benzeneacetic acid, |A-cyano-a-ethyl-, ethyl ester, I01-7049, J-522816, benzeneacetic acid, alpha-cyano-alpha-ethyl-, ethyl ester, N-(2,4-Dichloro-5-(4-(difluoromethyl)-3-methyl-5-oxo-4,5-dihydro-1h-1,2,4-triazol-1-yl)phenyl)-n-(methylsulfonyl)methanesulfonamide, C13H15NO2, Ethyl 2-cyano-2-phenyl-butanoate, Ethyl-2-phenyl-2-cyanobutylate 1g, AR-1I8371, CID250114, ACN-030513, |A-Cyano-|A-ethyl-benzeneacetic Acid Ethyl Ester, 92820-15-0,

Complexity	286
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.11g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	217.268g/mol
Monoisotopic Mass	217.11g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	50.1A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number