Cas no 89012-58-8 (Benzeneacetic acid, 2-methyl-, 2-hydroxyethyl ester)
89012-58-8 structure
Product Name:Benzeneacetic acid, 2-methyl-, 2-hydroxyethyl ester
CAS No:89012-58-8
MF:C11H14O3
MW:194.227063655853
CID:615920
PubChem ID:13203870
Update Time:2025-04-19
Benzeneacetic acid, 2-methyl-, 2-hydroxyethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetic acid, 2-methyl-, 2-hydroxyethyl ester
- 2-hydroxyethyl 2-(2-methylphenyl)acetate
- 2-Hydroxyethyl (2-methylphenyl)acetate
- 89012-58-8
- DTXSID10527374
-
- Inchi： 1S/C11H14O3/c1-9-4-2-3-5-10(9)8-11(13)14-7-6-12/h2-5,12H,6-8H2,1H3
- InChI Key： CISQGXKLFZSCKW-UHFFFAOYSA-N
- SMILES： O(CCO)C(CC1C=CC=CC=1C)=O
Computed Properties
- Exact Mass: 194.094294304g/mol
- Monoisotopic Mass: 194.094294304g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 179
- 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: 1.6
- Topological Polar Surface Area: 46.5?2
Benzeneacetic acid, 2-methyl-, 2-hydroxyethyl ester Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
89012-58-8 (Benzeneacetic acid, 2-methyl-, 2-hydroxyethyl ester) Related Products
- 5460-08-2(Ethyl mesitylacetate)
- 4606-15-9(Benzeneacetic acid,propyl ester)
- 14062-19-2(Ethyl p-Tolylacetate)
- 105337-18-6(Ethyl 2-(3,5-dimethylphenyl)acetate)
- 101-97-3(Ethyl phenylacetate)
- 36076-26-3(1,4-Phenylenediacetic Acid Diethyl Ester)
- 40061-55-0(Ethyl m-tolylacetate)
- 102-20-5(2-Phenylethyl 2-Phenylacetate)
- 40291-39-2(Ethyl o-tolylacetate)
- 40851-62-5(Methyl 2-(2-Methylphenyl)acetate)
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