AG0038L4

621-36-3 | 3-Methylphenylacetic acid

AG0038L4

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CAS Number	621-36-3
Catalog Number	AG0038L4(AGN-PC-0JKAFB)
Chemical Name	3-Methylphenylacetic acid
EC Number	210-683-9
IUPAC Name	2-(3-methylphenyl)acetic acid
InChI	InChI=1S/C9H10O2/c1-7-3-2-4-8(5-7)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
InChI Key	GJMPSRSMBJLKKB-UHFFFAOYSA-N
MDL Number	MFCD00004340
Molecular Formula	C9H10O2
Molecular Weight	150.1745
NSC Number	76090
SMILES	CC=1C=C(C=CC1)CC(=O)O
Synonyms	3-Methylphenylacetic acid, 621-36-3, m-Tolylacetic acid, 2-(m-Tolyl)acetic acid, 2-(3-methylphenyl)acetic acid, 3-tolylacetic acid, m-Methylphenylacetic acid, M-tolylaceticacid, (3-Methylphenyl)acetic acid, methyll 3-methylphenylacetate, Benzeneacetic acid, 3-methyl-, 2-m-tolylacetic acid, MFCD00004340, GJMPSRSMBJLKKB-UHFFFAOYSA-N, m-Tolylacetate, m-Tolylacetic acid, 97%, M-Tolylacetic acid (MTAA), 3-Tolylacetate, EINECS 210-683-9, m-tolyl acetic acid, m-Methylphenylacetate, m-Tolyl-acetic acid, 2-m-tolyl acetic acid, (3-Methylphenyl)acetate, M-TOLYACETIC ACID, AC1Q2NGO, 3-Methylbenzeneacetic acid, ACMC-1BIU0, m-Tolylacetic acid, 99%, AC1L1YW6, AC1Q2IK7, META-TOLYLACETIC ACID, KSC498A1R, SCHEMBL504093, ghl.PD_Mitscher_leg0.1056, CHEMBL136369, RARECHEM AL BO 0128, CHEBI:88356, CTK3J8018, GJMPSRSMBJLKKB-UHFFFAOYSA-, DTXSID30211147, OTAVA-BB 1287089, ZINC404470, KS-000017FP, NSC76090, STR06561, ANW-34073, NSC-76090, SBB068547, STL166136, AKOS000154311, AS00531, CM13725, MCULE-8658748020, NE10309, PS-5142, RP21371, VZ36243, AC-17035, AJ-22399, AK-77252, AN-46706, L551, SC-81493, DB-027265, RT-004174, TL8004045, CS-0046111, FT-0629020, ST24021884, ST50824219, EN300-62618, I14-7346, J-512919, F2191-0088, InChI=1/C9H10O2/c1-7-3-2-4-8(5-7)6-9(10)11/h2-5H,6H2,1H3,(H,10,11), MTAA, 3-Methylphenylacetate, 3-Methylphenylaceticacid, 2-(m-Tolyl)aceticacid, C9H10O2, CID12121, C9-H10-O2, T0880,

Complexity	143
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	150.068g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	150.177g/mol
Monoisotopic Mass	150.068g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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