AG003Q1B

40061-54-9 | Ethyl 2-(2-chlorophenyl)acetate

AG003Q1B

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CAS Number	40061-54-9
Catalog Number	AG003Q1B(AGN-PC-0MYFU7)
Chemical Name	Ethyl 2-(2-chlorophenyl)acetate
IUPAC Name	ethyl 2-(2-chlorophenyl)acetate
InChI	InChI=1S/C10H11ClO2/c1-2-13-10(12)7-8-5-3-4-6-9(8)11/h3-6H,2,7H2,1H3
InChI Key	MUANZYIPCHDGJH-UHFFFAOYSA-N
MDL Number	MFCD09264019
Molecular Formula	C10H11ClO2
Molecular Weight	198.6461
SMILES	ClC1=C(C=CC=C1)CC(=O)OCC
Synonyms	Ethyl 2-(2-chlorophenyl)acetate, 40061-54-9, Benzeneacetic acid, 2-chloro-, ethyl ester, ethyl o-chlorophenylacetate, SCHEMBL513530, CTK8C2856, DTXSID10435288, MUANZYIPCHDGJH-UHFFFAOYSA-N, KS-000001AT, 5301AB, ANW-69148, AR3392, MFCD09264019, ZINC34180401, 2-Chlorobenzeneacetic acid ethyl ester, AKOS000442210, AB50422, AJ-87333, AK-40513, (2-?Chlorophenyl)?acetic Acid Ethyl Ester, TC-157893, CS-0043127, X-2120, I01-7768, J-509164, C10H11ClO2, Ethyl2-(2-chlorophenyl)acetate, ETHYL 2-CHLOROPHENYLACETATE, 2-Chlorophenyl-acetic acid ethyl ester, CID10081468, Benzeneacetic acid, 3,5-dichloro-, ethyl ester, 200214-60-4,

Complexity	170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	198.045g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	198.646g/mol
Monoisotopic Mass	198.045g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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