AG000WV3

1272756-12-3 | Benzoic acid, 2-(carboxymethoxy)-4-fluoro-

AG000WV3

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CAS Number	1272756-12-3
Catalog Number	AG000WV3(AGN-PC-0JEK2O)
Chemical Name	Benzoic acid, 2-(carboxymethoxy)-4-fluoro-
IUPAC Name	2-(carboxymethoxy)-4-fluorobenzoic acid
InChI	InChI=1S/C9H7FO5/c10-5-1-2-6(9(13)14)7(3-5)15-4-8(11)12/h1-3H,4H2,(H,11,12)(H,13,14)
InChI Key	ZPFRPPABXMLDLB-UHFFFAOYSA-N
MDL Number	MFCD18651703
Molecular Formula	C9H7FO5
Molecular Weight	214.1473
SMILES	O=C(O)C1=CC=C(F)C=C1OCC(O)=O
Synonyms	2-(Carboxymethoxy)-4-fluorobenzoic Acid, 1272756-12-3, C9H7FO5, CTK8E1701, KS-00000CN0, 5267AJ, MFCD18651703, ZINC90696738, AKOS022183184, 2-(Carboxymethoxy)-4-fluorobenzoicAcid, TRA0059926, AS-32047, SY012810, AB0065975, AJ-129157, AX8268674, DB-020653, TC-306855, Benzoic acid, 2-(carboxymethoxy)-4-fluoro-, FT-0712435, K-3965, MFCD18651703 (97+%), 3395-40-2, 108-30-5,

Complexity	255
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.028g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	214.148g/mol
Monoisotopic Mass	214.028g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	83.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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