AG000RWN

1261645-53-7 | Benzeneacetic acid, 2-(difluoromethoxy)-6-fluoro-

AG000RWN

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CAS Number	1261645-53-7
Catalog Number	AG000RWN
Chemical Name	Benzeneacetic acid, 2-(difluoromethoxy)-6-fluoro-
IUPAC Name	2-[2-(difluoromethoxy)-6-fluorophenyl]acetic acid
InChI	InChI=1S/C9H7F3O3/c10-6-2-1-3-7(15-9(11)12)5(6)4-8(13)14/h1-3,9H,4H2,(H,13,14)
InChI Key	UGKBHLSJKAEXFZ-UHFFFAOYSA-N
MDL Number	MFCD18395034
Molecular Formula	C9H7F3O3
Molecular Weight	220.1453
SMILES	O=C(O)CC1=C(F)C=CC=C1OC(F)F
Synonyms	1261645-53-7, 2-(2-(Difluoromethoxy)-6-fluorophenyl)acetic acid, MFCD18395034, ZINC238670283, AS-46317, Benzeneacetic acid, 2-(difluoromethoxy)-6-fluoro-, 2-(Difluoromethoxy)-6-fluorophenylacetic acid,

Complexity	223
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.035g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	220.147g/mol
Monoisotopic Mass	220.035g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code	\N

Certificate of Analysis

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