AG00C6FU

3751-48-2 | Benzenepropanoic acid, 3-​methyl-

AG00C6FU

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CAS Number	3751-48-2
Catalog Number	AG00C6FU(AGN-PC-0C93JF)
Chemical Name	Benzenepropanoic acid, 3-​methyl-
IUPAC Name	3-(3-methylphenyl)propanoic acid
InChI	InChI=1S/C10H12O2/c1-8-3-2-4-9(7-8)5-6-10(11)12/h2-4,7H,5-6H2,1H3,(H,11,12)
InChI Key	VWXVTHDQAOAENP-UHFFFAOYSA-N
MDL Number	MFCD00060326
Molecular Formula	C10H12O2
Molecular Weight	164.2011
SMILES	C(CC(=O)O)c1cc(C)ccc1
Synonyms	3-(3-Methylphenyl)propionic acid, 3751-48-2, 3-(3-Methylphenyl)propanoic acid, 3-(m-tolyl)propanoic acid, 3-m-tolylpropionic acid, 3-M-TOLYLPROPANOIC ACID, VWXVTHDQAOAENP-UHFFFAOYSA-N, MFCD00060326, Propionic acid, 3-[3-methylphenyl]-, F9995-0951, AC1L3BXS, AC1Q2IKR, AC1Q2NGT, 3-m-tolyl-propionic acid, Hydrocinnamicacid,m-methyl-, 3-Methylbenzenepropanoic acid, Hydrocinnamic acid, m-methyl-, SCHEMBL456436, Benzenepropanoic acid,3-methyl-, CTK4H8333, KS-00001ERV, DTXSID60190956, 3-(M-TOLYL)PROPIONIC ACID, 3-(3'-Methylphenyl)propionic acid, CS-M2097, ZINC2528074, 3-(3-Methylphenyl)propanoic acid #, ANW-72304, SBB067747, AKOS000118018, AB02387, FS-1552, MCULE-1135918013, 3-(3-Methylphenyl)propionic acid, 97%, AJ-38222, AK-43934, FS000856, AB0000772, DB-021634, ST2404740, TC-066375, 4CH-019096, FT-0084128, FT-0635004, W5837, EN300-24264, VU0549417-1, C-5505, A823714, I14-5082, Z190662882, 3- propionicacid, 3-(3-Methylphenyl)propionicacid, Benzenepropanoic acid, 3-methyl-, C10H12O2, CID138042, ACN-031394, 3-(3-Methylphenyl)propionic acid, 96% - 1G 1g,

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	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

Lot Number