Basic information
- CAS
431-71-0- Standard SMILES
O=C(C(F)F)C(F)(F)F- InChIKey
WQAWXRFLNDAOON-UHFFFAOYSA-N- Molecular formula
- C3HF5O
- Average molar mass
- 148.03 g/mol
- Monoisotopic mass
- 147.99475546
Names & identifiers
- Preferred name
- Pentafluoroacetone
- IUPAC
- 1,1,1,3,3-pentafluoropropan-2-one
- English name
- pentafluoroacetone
- Molecular formula
- C3HF5O
- Molecular weight
- 148.03
Names & synonyms
Pentafluoroacetone431-71-02-Propanone, 1,1,1,3,3-pentafluoro-EINECS 207-077-1DTXSID7059989RefChem:859797DTXCID3040227207-077-11,1,1,3,3-pentafluoropropan-2-one1,1,1,3,3-pentafluoro-2-propanoneSevoflurane Impurity 20JC72CKF3K2
Show more names
1,1,1,3,3-pentafluoroacetoneCefalotin Impurity 1(Cefalotin EP Impurity A)
SCHEMBL891845SCHEMBL41041491,1,1,3,3-Pentafluoroacetone #NS00043402
Database identifiers
- CAS
431-71-0- PubChem CID
- 67939
- DTXSID
DTXSID7059989- UNII
- JC72CKF3K2
- EC Number
- 207-077-1
- Nikkaji
- J99.964D
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 114
Physicochemical properties
- FDA UNII
- 72 CKF3K2 · JC72CKF3K2
- EPA Substance Registry System
- 2 · 2-Propanone, 1,1,1,3,3-pentafluoro- (431-71-0)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Propanone, 1,1,1,3,3-pentafluoro-: INACTIVE
Suppliers5 total
杭州柏穗科技有限公司13858087543 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
7 records
Compound notes
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