AG003EX6

938-94-3 | 2-(4-Methylphenyl)propanoic acid

AG003EX6

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CAS Number	938-94-3
Catalog Number	AG003EX6(AGN-PC-0W3IA4)
Chemical Name	2-(4-Methylphenyl)propanoic acid
IUPAC Name	2-(4-methylphenyl)propanoic acid
InChI	InChI=1S/C10H12O2/c1-7-3-5-9(6-4-7)8(2)10(11)12/h3-6,8H,1-2H3,(H,11,12)
InChI Key	KDYOFXPLHVSIHS-UHFFFAOYSA-N
MDL Number	MFCD01111378
Molecular Formula	C10H12O2
Molecular Weight	164.2011
SMILES	CC1=CC=C(C=C1)C(C(=O)O)C
Synonyms	2-(4-tolyl)propanoic acid, 2-(4-tolyl)propanoic acid, (+-)-isomer, 2-(4-tolyl)propanoic acid, (R)-isomer, 2-(4-tolyl)propanoic acid, (S)-isomer, 2-(p-tolyl)propanoic acid, 2-(4-Methylphenyl)propanoic acid, 938-94-3, 2-(4-methylphenyl)propionic acid, 2-(p-Tolyl)propanoic acid, p-Methylhydratropic Acid, (R)-2-(p-Tolyl)propanoic acid, KDYOFXPLHVSIHS-UHFFFAOYSA-N, Propanoic acid, 2-(4-methylphenyl), MFCD01111378, (2RS)-2-(4-Methylphenyl)propanoic Acid, Ibuprofen Impurity D, alpha,4-Dimethylbenzeneacetic acid, 2-(4-Tolyl)propanoic acid, 124709-71-3, ACMC-209rnz, 2-p-tolylpropanoic acid, 4-methylhydratropic acid, 2-p-Tolylpropionic Acid, AC1Q1LGG, 4-methyl-hydratropic acid, p-methylphenylpropionic acid, 2-(p-tolyl)-propionic acid, a,4-Dimethylphenylacetic acid, SCHEMBL349312, AC1L456I, CHEMBL190275, CTK5H3814, alpha,4-Dimethylphenylacetic acid, 2-(p-Methylphenyl)propionic Acid, 2-(P-TOLYL)PROPIONIC ACID, 2-(4'-Methylphenyl)propionic acid, ANW-40125, SBB037860, AKOS004906184, Benzeneacetic acid, alpha,4-dimethyl-, MCULE-3998271570, RP22712, TRA0053879, alpha,4-Dimethylphenylacetic acid, 97%, AK-36931, AN-48100, AS-16020, R857, SC-46704, ST079297, SY023256, 2-(4-METHYLPHENYL) PROPANOIC ACID, AB0018373, DB-057444, TC-128870, FT-0633157, ST24039707, EN300-68757, M-2953, MFCD01111378 (97+%), I01-1781, J-506064, Z1259273171, ( inverted exclamation markA)-2-(p-Methylphenyl)propionic Acid, alpha,4-Dimethylphenylacetic acid, pharmaceutical impurity standard, 2- propanoicacid, UNII-1635C8OCXW, 2-(4-tolyl)propionic acid, |A-(p-Tolyl)propionic Acid, |A,4-Dimethylphenylacetic acid, 1635C8OCXW, |A,4-Dimethylbenzeneacetic Acid, C10H12O2, CID150866, C10-H12-O2, CS-O-31115, (2R)-2-(4-methylphenyl)propanoic acid, 2-(4-Methylphenyl)propanoic acid, 97% - 25G 25g,

Complexity	157
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.084g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.204g/mol
Monoisotopic Mass	164.084g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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

Lot Number