AG003QGL

4553-07-5 | Ethyl phenylcyanoacetate

AG003QGL

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	4553-07-5
Catalog Number	AG003QGL(AGN-PC-0RTUIV)
Chemical Name	Ethyl phenylcyanoacetate
EC Number	224-921-4
IUPAC Name	ethyl 2-cyano-2-phenylacetate
InChI	InChI=1S/C11H11NO2/c1-2-14-11(13)10(8-12)9-6-4-3-5-7-9/h3-7,10H,2H2,1H3
InChI Key	SXIRJEDGTAKGKU-UHFFFAOYSA-N
MDL Number	MFCD00001866
Molecular Formula	C11H11NO2
Molecular Weight	189.2105
NSC Number	362
SMILES	C(C(=O)OCC)(C#N)c1ccccc1
Synonyms	Ethyl phenylcyanoacetate, Ethyl 2-cyano-2-phenylacetate, 4553-07-5, Phenylcyanoacetic acid ethyl ester, ethyl cyano(phenyl)acetate, Ethyl cyanophenylacetate, ethylphenylcyanoacetate, Ethyl alpha-cyanophenylacetate, SXIRJEDGTAKGKU-UHFFFAOYSA-N, Ethyl alpha-cyano-alpha-phenylacetate, MFCD00001866, Acetic acid, cyanophenyl-, ethyl ester, alpha-cyanobenzeneacetic acid, ethyl ester, Benzeneacetic acid, alpha-cyano-, ethyl ester, Benzeneacetic acid, .alpha.-cyano-, ethyl ester, ACMC-1AEYQ, AC1L3TZX, ethyl-2-phenylcyanoacetate, AC1Q63PV, ETHYL PHENYLCYANOCETATE, SCHEMBL502194, Ethyl alpha-cyanobenzeneacetate, ethyl-2-cyano-2-phenylacetate, Ethyl phenylcyanoacetate, 95%, NSC362, Ethyl .alpha.-cyanophenylacetate, CHEBI:51926, NSC-362, Isocyanic Acid 5-Bromophenyl Ester, EINECS 224-921-4, ANW-13916, SBB054101, AKOS005203415, MCULE-3134278616, NE39364, VZ32046, AK-42096, DS-14028, ST082779, Ethyl .alpha.-cyano-.alpha.-phenylacetate, AI3-05831, DB-051315, TC-102661, P1255, Ethyl ester of .alpha.-cyanobenzeneacetic acid, S01-0240, W-200053, Acetic acid, ethyl ester, Ethyl phenylcyanoacetate, 97%, Benzeneacetic acid, ethyl ester, CID95298, AR-1I9686, 4819-02-7,

Complexity	235
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	189.079g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	189.214g/mol
Monoisotopic Mass	189.079g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	50.1A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H302-H312-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338-P264-P270-P271-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P501
UN Code	\N

Certificate of Analysis

Lot Number