AG002JEC

207974-19-4 | 2-(2,3-Difluorophenyl)-2-hydroxyacetic acid

AG002JEC

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CAS Number	207974-19-4
Catalog Number	AG002JEC(AGN-PC-0QWM6D)
Chemical Name	2-(2,3-Difluorophenyl)-2-hydroxyacetic acid
IUPAC Name	2-(2,3-difluorophenyl)-2-hydroxyacetic acid
InChI	InChI=1S/C8H6F2O3/c9-5-3-1-2-4(6(5)10)7(11)8(12)13/h1-3,7,11H,(H,12,13)
InChI Key	LBJOAPZLJUKPRG-UHFFFAOYSA-N
MDL Number	MFCD00061295
Molecular Formula	C8H6F2O3
Molecular Weight	188.1282
SMILES	OC(C1=CC=CC(F)=C1F)C(O)=O
Synonyms	2,3-Difluoromandelic acid, 207974-19-4, 2-(2,3-difluorophenyl)-2-hydroxyacetic acid, AC1LBTCG, SCHEMBL1668558, CTK8F0831, DTXSID30343275, LBJOAPZLJUKPRG-UHFFFAOYSA-N, 2,3-Difluoromandelic acid, 97%, MFCD00061295, SBB090697, AKOS009156551, FS-4798, MCULE-2057025185, VZ22253, 2,3-Difluoro-a-hydroxyphenylacetic acid, (2,3-Difluorophenyl)(hydroxy)acetic acid, AC-10455, AN-29833, I679, 2',3'-Difluoro-2-hydroxyphenylacetic acid, RT-006744, (2,3-Difluorophenyl)(hydroxy)acetic acid #, FT-0609621, ST50408117, 2-(2,3-difluorophenyl)-2-hydroxy-acetic acid, Benzeneacetic acid, 2,3-difluoro-alpha-hydroxy-, 974D194, A814914, J-013632, 2-[2,3-bis(fluoranyl)phenyl]-2-oxidanyl-ethanoic acid, C8H6F2O3, 2,3-DIFLUOROMANDELICACID, CID588650, D1061,

Complexity	198
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.029g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	188.13g/mol
Monoisotopic Mass	188.029g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

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