Basic information
- CAS
79-53-8- Standard SMILES
O=C(C(F)(F)F)C(F)(F)Cl- InChIKey
OJUUDWYPNQALHZ-UHFFFAOYSA-N- Molecular formula
- C3ClF5O
- Average molar mass
- 182.47 g/mol
- Monoisotopic mass
- 181.9557834
Names & identifiers
- Preferred name
- 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone
- IUPAC
- 1-chloro-1,1,3,3,3-pentafluoropropan-2-one
- English name
- CHLOROPENTAFLUOROACETONE
- Molecular formula
- C3ClF5O
- Molecular weight
- 182.48
Names & synonyms
79-53-81-chloro-1,1,3,3,3-pentafluoro-2-propanoneRefChem:1055202CHLOROPENTAFLUOROACETONE1-chloro-1,1,3,3,3-pentafluoropropan-2-oneC3ClF5O2-Propanone, 1-chloro-1,1,3,3,3-pentafluoro-MFCD000422182-Propanone,1-chloro-1,1,3,3,3-pentafluoro-PentafluorochloroacetonePentafluoromonochloroacetonealpha-Chloroperfluoroacetone
Show more names
α-chloroperfluoroacetoneChloropentafluoroacetone97%Chloropentafluoroacetone 97%monochloropentafluoro-aceton
Chloropentafluoro-2-propanoneAcetone, monochloropentafluoro-BRN 1773589AI3-52647Acetone, 1-chloro-1,1,3,3,3-pentafluoro-2-Propanone, 1-monochloro-1,1,3,3,3-pentafluoro-chlorpentafluoroacetoneSCHEMBL4184754
Database identifiers
- CAS
79-53-8- PubChem CID
- 6601
- DTXSID
DTXSID6073152- Nikkaji
- J3.846F
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 149
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- -133 °C · -133°C
- Boiling point
- 7 · 7,8°C
- Density
- 1.6463 · 1.6463 (estimate)
- CAS DataBase Reference
- 79 · 79-53-8(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- 2 · 2-Propanone, 1-chloro-1,1,3,3,3-pentafluoro- (79-53-8)
- Hazard Codes
- T
- Risk Statements
- 26 · 26-34-41-63
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 3308 · 3308
- Hazard Note
- Toxic
- HazardClass
- GAS, TOXIC
- HS Code
- 2914310000 · 2914310000
Safety & regulation
Safety data
- ridadr
- 3308
- hs_code
- 2914310000
- risk_code
- 26-34-41-63
- hazard_code
- T
- hazard_note
- Toxic
- safety_code
- 26-36/37/39-45
- hazard_class
- GAS, TOXIC
Chemistry & industry
Applications
UsesChloropentafluoroacetone is used to modify other compounds by the addiction of CF3 and CF2Cl groups.
Upstream & downstream products
Downstream products
Suppliers9 total
常州新氟化学有限公司13275212658 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
上海湄水化工科技有限公司021-60549325 18616193163
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
10 records
Compound notes
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