AG0028T0

203314-27-6 | 2-(2-Fluoro-5-methylphenyl)acetic acid

AG0028T0

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CAS Number	203314-27-6
Catalog Number	AG0028T0(AGN-PC-01LRD1)
Chemical Name	2-(2-Fluoro-5-methylphenyl)acetic acid
IUPAC Name	2-(2-fluoro-5-methylphenyl)acetic acid
InChI	InChI=1S/C9H9FO2/c1-6-2-3-8(10)7(4-6)5-9(11)12/h2-4H,5H2,1H3,(H,11,12)
InChI Key	CQFSSMCJXPLZAT-UHFFFAOYSA-N
MDL Number	MFCD06660230
Molecular Formula	C9H9FO2
Molecular Weight	168.1650
SMILES	O=C(O)CC1=CC(C)=CC=C1F
Synonyms	2-Fluoro-5-methylphenylacetic acid, 203314-27-6, 2-(2-fluoro-5-methylphenyl)acetic acid, Benzeneacetic acid, 2-fluoro-5-methyl-, MFCD06660230, (2-FLUORO-5-METHYLPHENYL)ACETIC ACID, ACMC-20anut, SCHEMBL868718, CTK4E3947, KS-00000ZOK, DTXSID00590638, CQFSSMCJXPLZAT-UHFFFAOYSA-N, JRD-1812, CK1027, SBB088160, ZINC12359222, AKOS002392937, AS00499, RP23083, 2-(2-fluoro-5-methyl-phenyl)acetic acid, AJ-61423, AN-29976, AS-18810, AB0030489, DB-066144, RT-007790, FT-0763652, X2687, 314F276, J-509459, Z2236735304, C9H9FO2, 2-Fluoro-5-methylphenylaceticacid,

Complexity	170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.059g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	168.167g/mol
Monoisotopic Mass	168.059g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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