AG003BA2

22084-89-5 | 3-(2-Methylphenyl)propionic acid

AG003BA2

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CAS Number	22084-89-5
Catalog Number	AG003BA2(AGN-PC-0JKLNN)
Chemical Name	3-(2-Methylphenyl)propionic acid
IUPAC Name	3-(2-methylphenyl)propanoic acid
InChI	InChI=1S/C10H12O2/c1-8-4-2-3-5-9(8)6-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)
InChI Key	JIRKNEAMPYVPTD-UHFFFAOYSA-N
MDL Number	MFCD00079773
Molecular Formula	C10H12O2
Molecular Weight	164.2011
SMILES	CC1=C(C=CC=C1)CCC(=O)O
Synonyms	3-(2-Methylphenyl)propionic acid, 22084-89-5, 3-(2-Methylphenyl)propanoic acid, 2-Methylhydrocinnamic acid, benzenepropanoic acid, 2-methyl-, 3-(o-tolyl)propanoic acid, 3-o-Tolylpropanoic acid, 2-methylbenzenepropanoic acid, Benzenepropanoic acid,2-methyl-, 3-[2-Methylphenyl]propionic acid, JIRKNEAMPYVPTD-UHFFFAOYSA-N, MFCD00079773, F9995-0950, 2-Methylhydrozimtsaure, ACMC-1BB6K, 3-(o-Tolyl)propionic acid, AC1L1KL7, AC1Q2F1O, KSC548K0T, SCHEMBL323867, 2-Methyl-benzenepropanoic acid, CHEMBL2252086, CTK4E8509, KS-00000FVR, DTXSID90176586, 2-Methylhydrocinnamic acid, 99%, ATTERCOP-CHM AT111341, OTAVA-BB 1512405, ZINC396095, 3-(2-methylphenyl)-propanoic acid, 3-(2'-Methylphenyl)propionic acid, 3-(2-Methylphenyl)propanoic acid #, ANW-44442, CL8849, AKOS000112360, AM83176, AS00516, CS-W005547, MCULE-1863841147, VZ25946, AJ-21594, AK-34171, AN-16460, BC684657, SC-27982, SY017785, TS-02195, AB0036193, DB-021597, ST2404713, TC-066376, 4CH-018380, FT-0638185, FT-0695559, Y3222, AZ0001-0381, EN300-62147, MFCD00079773 (98%), Q-9237, AE-562/43460471, I14-5086, J-014483, Z1259161827, 3- propionicacid, C10H12O2, CID30938, ACN-031406, 3-(2-Methylphenyl)propionic acid, 99% - 1G 1g, 77480-25-2,

Complexity	154
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	3
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

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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