CAS 422-61-7 Perfluoropropionyl fluoride (HCID 67912)

Names & identifiers

Preferred name: Perfluoropropionyl fluoride
IUPAC: 2,2,3,3,3-pentafluoropropanoyl fluoride
English name: Pentafluoropropionyl fluoride
Molecular formula: C3F6O
Molecular weight: 166.02

Names & synonyms

Pentafluoropropionyl fluoride422-61-7Perfluoropropionyl fluoride2,2,3,3,3-pentafluoropropanoyl fluoridePropanoyl fluoride, pentafluoro-EINECS 207-019-5DTXSID4059968Propanoyl fluoride, 2,2,3,3,3-pentafluoro-RefChem:860297Propanoyl fluoride, pentafluoroDTXCID4040056Propanoyl fluoride, 2,2,3,3,3pentafluoro

Show more names

perfluoropropanoyl fluoridepentafluoro-propanoylfluoridPentafluoropropionylfluoride97%Pentafluoropropionyl fluoride 97%1,2,2,3,3,3-Hexafluoro-1-propanone2,2,3,3,3-Pentafluoropropionyl fluoride

207-019-5MFCD00042078pentafluoropropanoyl fluoridePropanoyl fluoride,2,2,3,3,3-pentafluoro-CF3CF2COFC2F5COFSCHEMBL428729perfluoropropionic acid fluoride

Database identifiers

CAS: 422-61-7
PubChem CID: 67912
DTXSID: DTXSID4059968
EC Number: 207-019-5
Nikkaji: J196.092J

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 17.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 7
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 146

Experimental & physicochemical properties

Chemical ClassesToxic Gases & Vapors -> Acid Halides

PFAS · 2 items

PFAS -> Other/unspecified

Physical Description · 2 items

CBI

Liquefied gas; [Alfa Aesar MSDS]

Physicochemical properties

Boiling point: -30 °C · -30°C
Density: 1.537 · 1.537±0.06 g/cm3(Predicted)
EPA Substance Registry System: Propanoyl fluoride, pentafluoro- (422-61-7)
Symbol(GHS): 4 · GHS04,GHS06
Signal word: Danger
Hazard statements: 280 · H280-H330
Precautionary statements: 410 · P410+P403-P260-P271-P284-P304+P340-P310-P320-P403+P233-P405-P501
Hazard Codes: C,T
Risk Statements: 34 · 34
Safety Statements: 26 · 26-36/37/39
RIDADR: 3308 · 3308
Hazard Note: Corrosive
TSCA: TSCA listed
HazardClass: GAS, TOXIC, CORROSIVE
REACH Registrations: Active

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H280 (100%): Contains gas under pressure; may explode if heated [Warning Gases under pressure]

P260, P271, P284, P304+P340, P316, P320, P403+P233, P405, P410+P403, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 2 items

Propanoyl fluoride, 2,2,3,3,3-pentafluoro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanoyl fluoride, 2,2,3,3,3-pentafluoro- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 15-01-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/30339

Hazards SummaryLC50 (mouse) greater than 25 ppm/4hr but less than 100 ppm/4hr; [EPA - TSCATS] Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Alfa Aesar MSDS] See Propionyl chloride.

Hazard Classes and CategoriesPress. Gas (Liq.) (100%)

Toxicology

Adverse EffectsDermatotoxin - Skin burns.

Safety data

tsca: TSCA listed
ridadr: 3308
risk_code: 34
Signal word: Danger
Symbol(GHS): GHS04,GHS06
hazard_code: C,T
hazard_note: Corrosive
safety_code: 26-36/37/39
hazard_class: GAS, TOXIC, CORROSIVE
Hazard statements: H280-H330
REACH Registrations: Active
Precautionary statements: P410+P403-P260-P271-P284-P304+P340-P310-P320-P403+P233-P405-P501

Chemistry & industry

Uses & manufacturing

U.S. Production2023: 1,000,000 - <5,000,000 lb

Industry UsesIntermediate

General Manufacturing Information · 2 items

All Other Basic Organic Chemical Manufacturing

Propanoyl fluoride, 2,2,3,3,3-pentafluoro-: ACTIVE

Applications

UsesPentafluoropropionyl Fluoride is used as a reagent in the synthesis of perfluoroallyl fluorosulfate (FAFS) as a building block for fluoroallylic compounds.