Basic information
- CAS
216393-99-6- Standard SMILES
O=C(O)C(F)(F)C(F)(Br)C(F)(F)Cl- InChIKey
IFQBWLXWJWDSTE-UHFFFAOYSA-N- Molecular formula
- C4HBrClF5O2
- Average molar mass
- 291.4 g/mol
- Monoisotopic mass
- 289.87686
Names & identifiers
- Preferred name
- 3-Bromo-4-chloropentafluorobutyric acid
- IUPAC
- 3-bromo-4-chloro-2,2,3,4,4-pentafluorobutanoic acid
- English name
- 3-Bromo-4-chloropentafluorobutyric acid
- Molecular formula
- C4HBrClF5O2
- Molecular weight
- 291.4
Names & synonyms
216393-99-63-Bromo-4-chloropentafluorobutyric acid3-bromo-4-chloro-2,2,3,4,4-pentafluorobutanoic acidMFCD00153071C4HBrClF5O2SCHEMBL78258773-bromo-4-chloro-2,2,3,4,4-pentafluoro-butanoic AcidDTXSID00371222IFQBWLXWJWDSTE-UHFFFAOYSA-NAKOS024371052DB-045650CS-0449600
Show more names
3-Bromo-4-chloropentafluorobutyric3-Bromo-4-chloropentafluorobutyricacid97%3-Bromo-4-chloropentafluorobutyric acid 97%Butanoic acid, 3-bromo-4-chloro-2,2,3,4,4-pentafluoro-
ST51007269F0041543-bromo-4-chloro-2,2,3,4,4-pentafluorobutanoicacid
Database identifiers
- CAS
216393-99-6- PubChem CID
- 2736232
- DTXSID
DTXSID00371222- Nikkaji
- J1.424.389E
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 235
Physicochemical properties
- Boiling point
- 57 °C · 57°C 0,1mm
- Flash point
- 57 °C/0.1mm · 57°C/0.1mm
- CAS DataBase Reference
- 216393 · 216393-99-6(CAS DataBase Reference)
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314-H318
- Precautionary statements
- 260 h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a · P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a
- Hazard Codes
- C
- Risk Statements
- 34 · 34
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 3265 · 3265
- Hazard Note
- Corrosive
- HazardClass
- 8 · 8
- PackingGroup
- III
- HS Code
- 2915601990 · 2915601990
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
- ridadr
- 3265
- hs_code
- 2915601990
- risk_code
- 34
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- hazard_note
- Corrosive
- safety_code
- 26-36/37/39-45
- hazard_class
- 8
- packing_group
- III
- Hazard statements
- H314-H318
- Precautionary statements
- P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a
Chemistry & industry
Suppliers11 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
广东翁江化学试剂有限公司0751-2886750 13927877953 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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