Cas no 922-16-7 (2-Propenoic acid, 3-chloro-2-methyl-, methyl ester)
922-16-7 structure
Product Name:2-Propenoic acid, 3-chloro-2-methyl-, methyl ester
CAS No:922-16-7
MF:C5H7ClO2
MW:134.560880899429
CID:741855
PubChem ID:54075272
Update Time:2025-04-19
2-Propenoic acid, 3-chloro-2-methyl-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 3-chloro-2-methyl-, methyl ester
- Methyl 3-chloro-2-methyl-2-propenoate
- 922-16-7
- DTXSID401288566
-
- Inchi： 1S/C5H7ClO2/c1-4(3-6)5(7)8-2/h3H,1-2H3
- InChI Key： MJFYKGUKOYPESV-UHFFFAOYSA-N
- SMILES： ClC=C(C(=O)OC)C
Computed Properties
- Exact Mass: 134.0134572g/mol
- Monoisotopic Mass: 134.0134572g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 2
- Complexity: 118
- 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: 1.4
- Topological Polar Surface Area: 26.3?2
2-Propenoic acid, 3-chloro-2-methyl-, methyl ester Related Literature
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
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