1-Hexanesulfonyl chloride, 3,3,4,4,5,5,6,6,6-nonafluoro-
Basic information
- CAS
27619-88-1- Standard SMILES
O=S(=O)(Cl)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
VKUQIBIIJYOHSC-UHFFFAOYSA-N- Molecular formula
- C6H4ClF9O2S
- Average molar mass
- 346.6 g/mol
- Monoisotopic mass
- 345.9476817
Names & identifiers
- Preferred name
- 1-Hexanesulfonyl chloride, 3,3,4,4,5,5,6,6,6-nonafluoro-
- IUPAC
- 3,3,4,4,5,5,6,6,6-nonafluorohexane-1-sulfonyl chloride
- English name
- 3,3,4,4,5,5,6,6,6-nonafluorohexane-1-sulphonyl chloride
- Molecular formula
- C6H4ClF9O2S
- Molecular weight
- 346.6
Names & synonyms
1-Hexanesulfonyl chloride, 3,3,4,4,5,5,6,6,6-nonafluoro-EINECS 248-575-9RefChem:43302227619-88-13,3,4,4,5,5,6,6,6-nonafluorohexane-1-sulfonyl chloride3,3,4,4,5,5,6,6,6-Nonafluoro-1-hexanesulfonyl chlorideSCW5PLZ4L33,3,4,4,5,5,6,6,6-Nonafluorohexane-1-sulphonyl chlorideMFCD25961830UNII-SCW5PLZ4L3SCHEMBL4316105DTXSID2067327
Show more names
SY4909132-(Perfluorobutyl)ethane-1-sulfonyl chlorideNS00011045H598151-Hexanesulphonyl chloride, 3,3,4,4,5,5,6,6,6-nonafluoro-3,3,4,4,5,5,6,6,6-Nonafluoro-1-hexanesulphonyl chloride
Database identifiers
- CAS
27619-88-1- PubChem CID
- 119684
- DTXSID
DTXSID2067327- UNII
- SCW5PLZ4L3
- EC Number
- 248-575-9
- Nikkaji
- J250.559B
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 421
Experimental & physicochemical properties
PFAS
PFAS -> OECD Category
PFAS -> Other/unspecified
PFAS -> Other/unspecified
PFAS -> Other/unspecified
Physicochemical properties
- FDA UNII
- 5 PLZ4L3 · SCW5PLZ4L3
- EPA Substance Registry System
- 1 · 1-Hexanesulfonyl chloride, 3,3,4,4,5,5,6,6,6-nonafluoro- (27619-88-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- 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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing Information1-Hexanesulfonyl chloride, 3,3,4,4,5,5,6,6,6-nonafluoro-: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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