AG0000OY

1000520-92-2 | 2-(4-Fluoro-3-methylphenyl)acetic acid

AG0000OY

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CAS Number	1000520-92-2
Catalog Number	AG0000OY(AGN-PC-0WALNE)
Chemical Name	2-(4-Fluoro-3-methylphenyl)acetic acid
IUPAC Name	2-(4-fluoro-3-methylphenyl)acetic acid
InChI	InChI=1S/C9H9FO2/c1-6-4-7(5-9(11)12)2-3-8(6)10/h2-4H,5H2,1H3,(H,11,12)
InChI Key	VZDGZGNZGMJNPR-UHFFFAOYSA-N
MDL Number	MFCD09832241
Molecular Formula	C9H9FO2
Molecular Weight	168.1650
SMILES	O=C(O)CC1=CC=C(F)C(C)=C1
Synonyms	1000520-92-2, 2-(4-fluoro-3-methylphenyl)acetic acid, 4-FLUORO-3-METHYLPHENYLACETIC ACID, MFCD09832241, SCHEMBL1699671, CTK7J2265, KS-00000YNB, DTXSID40653458, VZDGZGNZGMJNPR-UHFFFAOYSA-N, 4-fluoro-3-methylphenylacetic aicd, SBB088168, ZINC31893035, (4-Fluoro-3-methylphenyl)acetic acid, AKOS011681040, Benzeneacetic acid, 4-fluoro-3-methyl-, AJ-84440, AS-46348, SC-12836, FT-0704044, 4-Fluoro-3-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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