1,1,1,2,3,4,4,4-Octafluoro-2,3-bis(trifluoromethyl)butane
Completing data — refresh the page later to see the latest
Basic information
- CAS
354-96-1- Standard SMILES
FC(F)(F)C(F)(C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F- InChIKey
NBQYGIPVNCVJJP-UHFFFAOYSA-N- Molecular formula
- C6F14
- Average molar mass
- 338.04 g/mol
- Monoisotopic mass
- 337.9776443
Names & identifiers
- Preferred name
- 1,1,1,2,3,4,4,4-Octafluoro-2,3-bis(trifluoromethyl)butane
- IUPAC
- 1,1,1,2,3,4,4,4-octafluoro-2,3-bis(trifluoromethyl)butane
- English name
- PERFLUORO(2,3-DIMETHYLBUTANE)
- Molecular formula
- C6F14
- Molecular weight
- 338.04
Names & synonyms
1,1,1,2,3,4,4,4-octafluoro-2,3-bis(trifluoromethyl)butaneRefChem:409361695-894-8354-96-1perfluoro-2,3-dimethylbutanePERFLUORO(2,3-DIMETHYLBUTANE)MFCD07784184Perfluor-2.3-dimethylbutanbutane, octafluoro-2,3-bis(trifluoromethyl)-2,3-Bis(trifluoromethyl)-1,1,1,2,3,4,4,4-octafluorobutaneSCHEMBL1271269Perfluoro-(2,3-Dimethylbutane)
Show more names
Perfluoro(2,3-dimethylbutane)80%2,3-bis(trifluoromethyl)-perfluorobutane2,3-Bis(trifluoromethyl)octafluorobutanebutane,octafluoro-2,3-bis(trifluoromethyl)-1,1,1,2,3,4,4,4-Octafluoro-2,3-dimethylbutaneButane, 1,1,1,2,3,4,4,4-octafluoro-2,3-bis(trifluoromethyl)-
DTXSID70334445Perfluoro(2,3-dimethylbutane) 80%AKOS025310370FO95041NS00018974
Database identifiers
- CAS
354-96-1- PubChem CID
- 520741
- DTXSID
DTXSID70334445- EC Number
- 695-894-8
- Nikkaji
- J95.359H
Properties
Computed structural propertiesFilling in
- XLogP
- 5.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 284
Experimental & physicochemical properties
PFAS
PFAS -> Other/unspecified
PFAS -> Other/unspecified
PFAS -> OECD Category
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- -15 °C · -15°C
- Boiling point
- 55.56 °C · 55.56°C (estimate)
- Density
- 1.676 · 1.6760 (rough estimate)
- refractive index
- 1.2589 · 1.2589 (estimate)
- form
- liquid
- color
- Clear
- EPA Substance Registry System
- -2 · Perfluoro-2,3-dimethylbutane (354-96-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
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 Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2903493090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P271-P280
Chemistry & industry
Uses & manufacturing
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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