AG000FOH

1150164-80-9 | Benzeneacetic acid, α,α-difluoro-2-methoxy-, ethyl ester

AG000FOH

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CAS Number	1150164-80-9
Catalog Number	AG000FOH(AGN-PC-0WBS6Q)
Chemical Name	Benzeneacetic acid, α,α-difluoro-2-methoxy-, ethyl ester
IUPAC Name	ethyl 2,2-difluoro-2-(2-methoxyphenyl)acetate
InChI	InChI=1S/C11H12F2O3/c1-3-16-10(14)11(12,13)8-6-4-5-7-9(8)15-2/h4-7H,3H2,1-2H3
InChI Key	ZYZZZXOHDXPMGK-UHFFFAOYSA-N
MDL Number	MFCD12026027
Molecular Formula	C11H12F2O3
Molecular Weight	230.2080
SMILES	CCOC(=O)C(F)(F)C1=C(OC)C=CC=C1
Synonyms	ETHYL 2,2-DIFLUORO-2-(2-METHOXYPHENYL)ACETATE, 1150164-80-9, ACMC-2099oi, SCHEMBL9275981, CTK4A9103, KS-00000QRA, DTXSID60674963, ZYZZZXOHDXPMGK-UHFFFAOYSA-N, C11H12F2O3, ANW-16816, MFCD12026027, ZINC38537393, AKOS011682683, Ethyl difluoro(2-methoxyphenyl)acetate, RTR-002815, AJ-96107, AK-96371, CJ-19454, DS-18069, SY038871, ethyl difluoro-2-(2-methoxyphenyl)acetate, TR-002815, Z7593, MFCD12026027 (95%), A-5118, (2-Methoxyphenyl)difluoroacetic acid ethyl ester, I14-25364, Benzeneacetic acid, alpha,alpha-difluoro-2-methoxy-, ethyl ester, Ethyl2,2-difluoro-2-(2-methoxyphenyl)acetate,

Complexity	243
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	230.075g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	230.211g/mol
Monoisotopic Mass	230.075g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

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

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