Basic information
- CAS
354-34-7- Standard SMILES
O=C(F)C(F)(F)F- InChIKey
DCEPGADSNJKOJK-UHFFFAOYSA-N- Molecular formula
- C2F4O
- Average molar mass
- 116.01 g/mol
- Monoisotopic mass
- 115.98852727
Names & identifiers
- Preferred name
- Trifluoroacetyl fluoride
- IUPAC
- 2,2,2-trifluoroacetyl fluoride
- English name
- Perfluoroacetyl fluoride
- Molecular formula
- C2F4O
- Molecular weight
- 116.01
Names & synonyms
Show more names
Database identifiers
- CAS
354-34-7- PubChem CID
- 67716
- DTXSID
DTXSID6059867- EC Number
- 206-558-3
- Nikkaji
- J26.717A
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 82
Physicochemical properties
- Melting point
- -159.46 °C · -159.46°C
- Boiling point
- -59 °C · -59°C
- Density
- 1.44 · 1.440±0.06 g/cm3(Predicted)
- Henry's Law Constant
- 3 · 3.0×10-2 mol/(m3Pa) at 25℃, Mirabel et al. (1996)
- InChI
- InChI=1S/C2F4O/c3-1(7)2(4,5)6
- InChIKey
- DCEPGADSNJKOJK-UHFFFAOYSA-N
- SMILES
- C(F)(C(F)(F)F)=O
- NIST Chemistry Reference
- 3 CFO · CF3CFO(354-34-7)
- EPA Substance Registry System
- Acetyl fluoride, trifluoro- (354-34-7)
- Symbol(GHS)
- 8 · GHS08,GHS06
- Signal word
- Danger
- Hazard statements
- 371 · H371-H330-H373
- Precautionary statements
- 260 · P260-P314-P501-P260-P271-P284-P304+P340-P310-P320-P403+P233-P405-P501-P260-P264-P270-P309+P311-P405-P501
- Hazard Codes
- C,T
- Risk Statements
- 26 · 26-35
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 3308 · 3308
- Hazard Note
- Corrosive
- TSCA
- TSCA listed
- HazardClass
- GAS, TOXIC
Safety & regulation
GHS classification
GHS Classification
Danger
H280 (100%): Contains gas under pressure; may explode if heated [Warning Gases under pressure];H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H330 (100%): Fatal if inhaled [Danger Acute toxicity, inhalation];H370 (100%): Causes damage to organs [Danger Specific target organ toxicity, single exposure];H372 (100%): Causes damage to organs through prolonged or repeated exposure [Danger Specific target organ toxicity, repeated exposure]
P260, P264, P264+P265, P270, P271, P280, P284, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P308+P316, P316, P317, P319, P320, P321, P363, P403+P233, P405, P410+P403, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Safety data
- tsca
- TSCA listed
- ridadr
- 3308
- risk_code
- 26-35
- Signal word
- Danger
- Symbol(GHS)
- GHS08,GHS06
- hazard_code
- C,T
- hazard_note
- Corrosive
- safety_code
- 26-36/37/39-45
- hazard_class
- GAS, TOXIC
- Hazard statements
- H371-H330-H373
- Precautionary statements
- P260-P314-P501-P260-P271-P284-P304+P340-P310-P320-P403+P233-P405-P501-P260-P264-P270-P309+P311-P405-P501
Chemistry & industry
Uses & manufacturing
Applications
UsesTrifluoroacetyl Fluoride is a chemical known to contribute to greenhouse gas CF4.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers36 total
Related reactions
Compound notes
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