Cas no 85153-65-7 (2-Butenoic acid,3-ethoxy-, methyl ester)
85153-65-7 structure
Product Name:2-Butenoic acid,3-ethoxy-, methyl ester
CAS No:85153-65-7
MF:C7H12O3
MW:144.168382644653
CID:731178
PubChem ID:3020450
Update Time:2024-03-01
2-Butenoic acid,3-ethoxy-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Butenoic acid,3-ethoxy-, methyl ester
- methyl 3-ethoxy-2-butenoate
- methyl 3-ethoxybut-2-enoate
- 3-Ethoxy-2-butenoic acid methyl ester
- Einecs 285-848-1
- 2-Butenoic acid, 3-ethoxy-, methyl ester
-
- Inchi： 1S/C7H12O3/c1-4-10-6(2)5-7(8)9-3/h5H,4H2,1-3H3
- InChI Key： ORXGGVRQTQZUJW-UHFFFAOYSA-N
- SMILES： C(OC)(=O)C=C(OCC)C
Computed Properties
- Exact Mass: 144.078644
- Monoisotopic Mass: 144.078644
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 138
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 35.5
- XLogP3: 1.1
Experimental Properties
- Density: 0.978
- Boiling Point: 188.6°Cat760mmHg
- Flash Point: 69.3°C
- Refractive Index: 1.427
2-Butenoic acid,3-ethoxy-, methyl ester Related Literature
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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4. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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