Basic information
- CAS
918-22-9- Standard SMILES
FC(F)(Br)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)Br- InChIKey
SWAPKQWKFYIOJS-UHFFFAOYSA-N- Molecular formula
- BrC6F12Br
- Average molar mass
- 459.85 g/mol
- Monoisotopic mass
- 457.81751
Names & identifiers
- Preferred name
- 1,6-Dibromododecafluorohexane
- IUPAC
- 1,6-dibromo-1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane
- English name
- 1,6-DIBROMOPERFLUOROHEXANE
- Molecular formula
- C6Br2F12
- Molecular weight
- 459.85
Names & synonyms
1,6-Dibromododecafluorohexane918-22-9DTXSID20335129RefChem:221511DTXCID70286218670-422-31,6-Dibromoperfluorohexane1,6-dibromo-1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexaneMFCD00153110Perfluoro(1,6-dibromohexane)C6Br2F12Hexane, 1,6-dibromo-dodecafluoro-
Show more names
DIBROMOPERFLUOROHEXANE1,6-Dibromodecafluorohexane1,6-Dibromoperfluorohexane96%1,6-Dibromoperfluorohexane 96%1,6-Dibromododecafluorohexane>1,6-Dibromo-1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane1,6-Dibromodecafluorohexane~Perfluoro-1,6-dibromohexane
starbld0018534Perfluoro-1,6-dibromohexaneSCHEMBL2721109SWAPKQWKFYIOJS-UHFFFAOYSA-NAKOS015833868LS-13108SY049247DB-057271
Database identifiers
- CAS
918-22-9- PubChem CID
- 522992
- DTXSID
DTXSID20335129- EC Number
- 670-422-3
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 338
Experimental & physicochemical properties
PFAS
PFAS -> non-polymer
PFAS -> Other/unspecified
PFAS -> OECD Category
PFAS -> Other/unspecified
PFAS -> Other Nonpolymers
Physicochemical properties
- Boiling point
- 142 °C · 142 °C
- Density
- 2.1 · 2.10
- refractive index
- 1.345 · 1.3450
- Flash point
- 141 · 141-142°C
- storage temp.
- 0 · 0-10°C
- form
- clear liquid
- color
- Colorless to Almost colorless
- Water Solubility
- Soluble in water.
- BRN
- 1822184 · 1822184
- InChI
- InChI=1S/C17H23NO6S/c1-17(2,3)24-16(21)18-10-8-12(9-11-18)25(22,23)14-7-5-4-6-13(14)15(19)20/h4-7,12H,8-11H2,1-3H3,(H,19,20)
- InChIKey
- SWAPKQWKFYIOJS-UHFFFAOYSA-N
- SMILES
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)
Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- WGK 3
- hs_code
- 29037800
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 26-37/39
- Storage Class
- 10 - Combustible liquids
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Uses & manufacturing
Uses
• Solvent for printing ink [Ref: CAS2019 (CN109810567)]
non-polymer PFAS -> Printing (Inks) -> Toner and printer inks
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
Upstream & downstream products
Downstream products
Suppliers46 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
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]
上海腾准生物科技有限公司19821570922 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…