Basic information
- CAS
51249-64-0- Standard SMILES
C=C(Br)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
KSXRFZHNNOXBLE-UHFFFAOYSA-N- Molecular formula
- C8H2BrF13
- Average molar mass
- 424.98 g/mol
- Monoisotopic mass
- 423.91323
Names & identifiers
- Preferred name
- 2-Bromo-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooct-1-ene
- IUPAC
- 2-bromo-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooct-1-ene
- English name
- 1-Bromo-1-(perfluorohexyl)ethylene
- Molecular formula
- C8H2BrF13
- Molecular weight
- 424.98
Names & synonyms
51249-64-02-bromo-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooct-1-ene2-Bromo-1H,1H-perfluorooct-1-ene1-Bromo-1-(perfluorohexyl)ethylene2-Bromo-2-(Perfluorohexyl)ethene2-bromo-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-1-octeneMFCD001537281-Bromo-1-(perfluoro-n-hexyl)ethylene2-bromo-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-oct-1-eneSCHEMBL30775478DTXSID20371305KSXRFZHNNOXBLE-UHFFFAOYSA-N
Show more names
1H,1H-2-Bromoperfluorooct-1-ene1-Octene, 2-bromo-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-
AKOS007930088NS00019103
Database identifiers
- CAS
51249-64-0- PubChem CID
- 2736359
- DTXSID
DTXSID20371305
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 445
Experimental & physicochemical properties
PFAS
PFAS -> Other/unspecified
PFAS -> OECD Category
PFAS -> Other/unspecified
Physicochemical properties
- Boiling point
- 38 °C · 38°C 15mm
- EPA Substance Registry System
- 2 · 2-Bromo-2-(P+D1581erfluorohexyl)ethene (51249-64-0)
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- Hazard Note
- Irritant
- HS Code
- 2903780090 · 2903780090
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
- hs_code
- 2903780090
- risk_code
- 36/37/38
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 26-36
Chemistry & industry
Uses & manufacturing
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
Suppliers8 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
常州新氟化学有限公司0519-85528066; 13275212658 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]
中科双航化学（大连）有限公司+86-411-66858498 13941194417 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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