Cas no 53588-93-5 (2-Propenoic acid,3-(acetyloxy)-, methyl ester)
53588-93-5 structure
Product Name:2-Propenoic acid,3-(acetyloxy)-, methyl ester
2-Propenoic acid,3-(acetyloxy)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid,3-(acetyloxy)-, methyl ester
- methyl 3-acetoxyacrylate
- methyl (2E)-3-(acetyloxy)prop-2-enoate
- methyl 3-(acetyloxy)prop-2-enoate
- EINECS 258-652-9
- 53588-93-5
- DTXSID50968363
-
- Inchi： 1S/C6H8O4/c1-5(7)10-4-3-6(8)9-2/h3-4H,1-2H3
- InChI Key： MSQPGECJSAMXBT-UHFFFAOYSA-N
- SMILES： O(C(C)=O)C=CC(=O)OC
Computed Properties
- Exact Mass: 144.04224
- Monoisotopic Mass: 144.042
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 159
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 0.1
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- Density: 1.124
- Boiling Point: 174.8°Cat760mmHg
- Flash Point: 79.8°C
- Refractive Index: 1.435
- PSA: 52.6
2-Propenoic acid,3-(acetyloxy)-, methyl 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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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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