Basic information
- CAS
127117-30-0- Standard SMILES
CCC(F)(F)C(F)(F)Br- InChIKey
CKZRVAPVPPFLQX-UHFFFAOYSA-N- Molecular formula
- C4H5BrF4
- Average molar mass
- 208.98 g/mol
- Monoisotopic mass
- 207.95108
Names & identifiers
- Preferred name
- 1-Bromo-1,1,2,2-tetrafluorobutane
- IUPAC
- 1-bromo-1,1,2,2-tetrafluorobutane
- English name
- 1-Bromo-1,1,2,2-tetrafluorobutane
- Molecular formula
- C4H5BrF4
- Molecular weight
- 208.98
Names & synonyms
1-bromo-1,1,2,2-tetrafluorobutane127117-30-0MFCD00077466Butane, 1-bromo-1,1,2,2-tetrafluoro-SCHEMBL246556SCHEMBL5539224DTXSID703713104-bromo-3,3,4,4-tetrafluorobutaneSBB094125AKOS025212028
Database identifiers
- CAS
127117-30-0- PubChem CID
- 2736366
- DTXSID
DTXSID70371310
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 101
Physicochemical properties
- Boiling point
- 134 · 134-144°C
- Density
- 1.612 · 1.612±0.06 g/cm3(Predicted)
- form
- liquid
- color
- Clear
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 271 · P271
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- Hazard Note
- Irritant
- HS Code
- 2903793090 · 2903793090
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
- 2903793090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P271
Chemistry & industry
Suppliers5 total
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]
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]
Related reactions
1 records
Compound notes
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