Cas no 107274-42-0 (2-Propenoic acid, 3-(2-methoxy-5-methylphenyl)-, ethyl ester)
107274-42-0 structure
Product Name:2-Propenoic acid, 3-(2-methoxy-5-methylphenyl)-, ethyl ester
CAS No:107274-42-0
MF:C13H16O3
MW:220.264344215393
CID:2137848
Update Time:2023-11-19
2-Propenoic acid, 3-(2-methoxy-5-methylphenyl)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- (E)-ethyl 3-(2-methoxy-5-methylphenyl)acrylate
- HPUXUPRHTNBDSE-SOFGYWHQSA-N
- ethyl (2E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoate
- CID 121004079
- 2-Propenoic acid, 3-(2-methoxy-5-methylphenyl)-, ethyl ester
- Ethyl 3-(2-methoxy-5-methylphenyl)-2-propenoate
-
- Inchi： 1S/C13H16O3/c1-4-16-13(14)8-6-11-9-10(2)5-7-12(11)15-3/h5-9H,4H2,1-3H3/b8-6+
- InChI Key： HPUXUPRHTNBDSE-SOFGYWHQSA-N
- SMILES： O(C)C1C=CC(C)=CC=1/C=C/C(=O)OCC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 248
- Topological Polar Surface Area: 35.5
Experimental Properties
- Density: 1.063±0.06 g/cm3(Predicted)
- Boiling Point: 148-150 °C(Press: 0.5 Torr)
2-Propenoic acid, 3-(2-methoxy-5-methylphenyl)-, ethyl ester Related Literature
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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