Cas no 137932-33-3 (m-Toluylic acid, benzyl ester)
m-Toluylic acid, benzyl ester structure
Product Name:m-Toluylic acid, benzyl ester
CAS No:137932-33-3
MF:C15H14O2
MW:226.270464420319
CID:902014
PubChem ID:226951
Update Time:2025-04-19
m-Toluylic acid, benzyl ester Chemical and Physical Properties
Names and Identifiers
-
- m-Toluylic acid, benzyl ester
- Benzyl 3-methylbenzoate #
- AN-652/41399045
- Benzyl 3-methylbenzoate
- MQFWKCFSZJWETP-UHFFFAOYSA-N
- NSC-17940
- NSC17940
- m-Toluic acid, benzyl ester
- SCHEMBL6057244
- 137932-33-3
-
- Inchi： 1S/C15H14O2/c1-12-6-5-9-14(10-12)15(16)17-11-13-7-3-2-4-8-13/h2-10H,11H2,1H3
- InChI Key： MQFWKCFSZJWETP-UHFFFAOYSA-N
- SMILES： O(C(C1=CC=CC(C)=C1)=O)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 226.099
- Monoisotopic Mass: 226.099
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 243
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.3
- Topological Polar Surface Area: 26.3?2
m-Toluylic acid, benzyl ester Related Literature
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
137932-33-3 (m-Toluylic acid, benzyl ester) Related Products
- 120-51-4(Benzyl benzoate)
- 1679-64-7(Mono-Methyl terephthalate)
- 87-24-1(Ethyl 2-methylbenzoate)
- 99-75-2(Methyl p-Toluate)
- 1459-93-4(Dimethyl isophthalate)
- 93-97-0(Benzoic anhydride)
- 94-08-6(Ethyl p-toluate)
- 99-36-5(Methyl 3-methylbenzoate)
- 140-11-4(Benzyl acetate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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