Basic information
- CAS
78239-65-3- Standard SMILES
O=C(F)c1ccc(F)c(Br)c1- InChIKey
AIOKJVVAYNKWQP-UHFFFAOYSA-N- Molecular formula
- C7H3BrF2O
- Average molar mass
- 221 g/mol
- Monoisotopic mass
- 219.93353326
Names & identifiers
- Preferred name
- 3-Bromo-4-fluorobenzoyl fluoride
- IUPAC
- 3-bromo-4-fluorobenzoyl fluoride
- English name
- 3-BROMO-4-FLUORO-BENZOYL FLUORIDE
- Molecular formula
- C7H3BrF2O
- Molecular weight
- 221
Names & synonyms
3-bromo-4-fluorobenzoyl fluoride78239-65-33-Bromo-4-fluoro-benzoyl fluorideMFCD049726893-bromo-4-fluorobenzoylfluoride3-bromo-4-fluoro-benzoylfluorideSCHEMBL105556934-fluoro-3-bromobenzoyl fluorideDTXSID10513055AIOKJVVAYNKWQP-UHFFFAOYSA-NSBB096074AKOS025311292
Show more names
3-Bromo-4-fluorobenzoylfluoride98%Benzoyl fluoride, 3-bromo-4-fluoro-3-Bromo-4-fluorobenzoyl fluoride 98%
Database identifiers
- CAS
78239-65-3- PubChem CID
- 12922707
- DTXSID
DTXSID10513055
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Hazard Codes
- C
- Risk Statements
- 34 · 34
- Safety Statements
- 26 · 26-36/37/39
- RIDADR
- 3261 · 3261
- Hazard Note
- Corrosive
- HS Code
- 2918999090 · 2918999090
Safety & regulation
Safety data
- ridadr
- 3261
- hs_code
- 2918999090
- risk_code
- 34
- hazard_code
- C
- hazard_note
- Corrosive
- safety_code
- 26-36/37/39
Chemistry & industry
Suppliers6 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
山东领海生物科技有限公司15092083467 · [email protected]
上海金源瑞医药科技有限公司021-18217523 18217523428 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
9 records
Compound notes
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