2-Fluoroethyl 2-fluoroacetate
Basic information
- CAS
459-99-4- Standard SMILES
O=C(CF)OCCF- InChIKey
ZIJVALRYXQXDOL-UHFFFAOYSA-N- Molecular formula
- C4H6F2O2
- Average molar mass
- 124.09 g/mol
- Monoisotopic mass
- 124.03358575
Names & identifiers
- Preferred name
- 2-Fluoroethyl 2-fluoroacetate
- IUPAC
- 2-fluoroethyl 2-fluoroacetate
- English name
- Fluoroacetic acid 2-fluoroethyl ester
- Molecular weight
- 0
Names & synonyms
2-fluoroethyl 2-fluoroacetate459-99-4Fluoroethyl fluoroacetateNR4H23SR3QDTXSID20196651RefChem:1063115DTXCID601191422-FLUOROETHYL FLUOROACETATETL 855beta-Fluoroethyl fluoroacetateBRN 1749277Acetic acid, fluoro-, (2-fluoroethyl) ester
Show more names
TL-855Fluoroacetic acid 2-fluoroethyl ester
2-Fluorethylester kyseliny fluoroctove [Czech]2-Fluorethylester kyseliny fluoroctoveUNII-NR4H23SR3QSCHEMBL14244429fluoro-acetic acid 2-fluoro-ethyl esterACETIC ACID, FLUORO-, 2-FLUOROETHYL ESTER
Database identifiers
- CAS
459-99-4- PubChem CID
- 9992
- DTXSID
DTXSID20196651- UNII
- NR4H23SR3Q
- Nikkaji
- J86.208H
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 74.4
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Boiling point
- 147.79 °C · 147.79°C (rough estimate)
- Density
- 1.1926 · 1.1926 (estimate)
- FDA UNII
- 4 H23SR3Q · NR4H23SR3Q
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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Compound notes
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