1-Chlorononafluorobutane
Basic information
- CAS
558-89-4- Standard SMILES
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)Cl- InChIKey
GIUDNRMHWCAPGM-UHFFFAOYSA-N- Molecular formula
- ClC4F9
- Average molar mass
- 254.48 g/mol
- Monoisotopic mass
- 253.9544812
Names & identifiers
- Preferred name
- 1-Chlorononafluorobutane
- IUPAC
- 1-chloro-1,1,2,2,3,3,4,4,4-nonafluorobutane
- English name
- 1-CHLORONONAFLUOROBUTANE
- Molecular formula
- C4ClF9
- Molecular weight
- 254.48
Names & synonyms
1-Chlorononafluorobutane558-89-41-chloro-1,1,2,2,3,3,4,4,4-nonafluorobutaneDTXSID70371491RefChem:431502DTXCID30322525805-724-8MFCD007981304-chloro-1,1,1,2,2,3,3,4,4-nonafluorobutaneSCHEMBL793254GIUDNRMHWCAPGM-UHFFFAOYSA-NSBB101454
Show more names
1-CHLORONONFLUOROBUTANE1-Chlorononafluorobutane96%1-Chlorononafluorobutane 96%Butane, 1-chloro-1,1,2,2,3,3,4,4,4-nonafluoro-
AKOS007930101DB-052816NS001112151-Chlorononafluorobutane; Perfluorobutyl chloride
Database identifiers
- CAS
558-89-4- PubChem CID
- 2736628
- DTXSID
DTXSID70371491- EC Number
- 805-724-8
- Nikkaji
- J1.161.074I
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 215
Experimental & physicochemical properties
PFAS
PFAS -> OECD Category
PFAS -> Other Nonpolymers
PFAS -> Other/unspecified
Physicochemical properties
- Boiling point
- 29 °C · 29°C
- CAS DataBase Reference
- 558 · 558-89-4(CAS DataBase Reference)
- EPA Substance Registry System
- 1 · 1-Chlorononafluorobutane (558-89-4)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 280 · P280-P312-P261
- Hazard Codes
- Xi
- Safety Statements
- 23 · 23
- Hazard Note
- Irritant
- HazardClass
- GAS
- HS Code
- 2903779090 · 2903779090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS ClassificationNot Classified
Hazard information
Hazard Classes and CategoriesNot Classified
Safety data
- hs_code
- 2903779090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 23
- hazard_class
- GAS
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P280-P312-P261
Chemistry & industry
Uses & manufacturing
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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