Cas no 433-52-3 (Acetic acid, chlorofluoro-, methyl ester)
433-52-3 structure
Product Name:Acetic acid, chlorofluoro-, methyl ester
CAS No:433-52-3
MF:C3H4ClFO2
MW:126.514063835144
CID:2827589
PubChem ID:12707600
Update Time:2025-04-21
Acetic acid, chlorofluoro-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- chloro-fluoro-acetic acid methyl ester
- 433-52-3
- SCHEMBL11411272
- DTXSID70507551
- Methyl chloro(fluoro)acetate
- Acetic acid, chlorofluoro-, methyl ester
-
- Inchi： 1S/C3H4ClFO2/c1-7-3(6)2(4)5/h2H,1H3
- InChI Key： BOAUPQGHNSRKQU-UHFFFAOYSA-N
- SMILES： ClC(C(=O)OC)F
Computed Properties
- Exact Mass: 125.9883852g/mol
- Monoisotopic Mass: 125.9883852g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 7
- Rotatable Bond Count: 2
- Complexity: 75.3
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.2
- Topological Polar Surface Area: 26.3?2
Acetic acid, chlorofluoro-, methyl ester Related Literature
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
-
Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
-
S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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