Cas no 186019-68-1 (Methyl 2-(2-ethoxyphenyl)acetate)
186019-68-1 structure
Product Name:Methyl 2-(2-ethoxyphenyl)acetate
CAS No:186019-68-1
MF:C11H14O3
MW:194.227063655853
CID:2109129
Update Time:2023-08-03
Methyl 2-(2-ethoxyphenyl)acetate Chemical and Physical Properties
Names and Identifiers
-
- methyl 2-(2-ethoxyphenyl)acetate
- 2-ETHOXY-BENZENEACETIC ACID METHYL ESTER
- BENZENEACETIC ACID, 2-ETHOXY-, METHYL ESTER
- Methyl 2-(2-ethoxyphenyl)acetate
-
- Inchi： 1S/C11H14O3/c1-3-14-10-7-5-4-6-9(10)8-11(12)13-2/h4-7H,3,8H2,1-2H3
- InChI Key： JICQNKPALJUINZ-UHFFFAOYSA-N
- SMILES： O(CC)C1C=CC=CC=1CC(=O)OC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 179
- Topological Polar Surface Area: 35.5
Methyl 2-(2-ethoxyphenyl)acetate Related Literature
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Xu Jie,Deng Xu,Weili Wei RSC Adv., 2019,9, 29149-29153
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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