4-Bromo-6-fluoro-2-(trifluoromethyl)quinoline
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Basic information
- CAS
31009-33-3- Standard SMILES
Fc1ccc2nc(C(F)(F)F)cc(Br)c2c1- InChIKey
JMZGVHLYCHYQEH-UHFFFAOYSA-N- Molecular formula
- C10H4BrF4N
- Average molar mass
- 294.04 g/mol
- Monoisotopic mass
- 292.94632
Names & identifiers
- Preferred name
- 4-Bromo-6-fluoro-2-(trifluoromethyl)quinoline
- IUPAC
- 4-bromo-6-fluoro-2-(trifluoromethyl)quinoline
- English name
- 4-BROMO-6-FLUORO-2-(TRIFLUOROMETHYL)QUINOLINE
- Molecular formula
- C10H4BrF4N
- Molecular weight
- 294.04
Names & synonyms
4-bromo-6-fluoro-2-(trifluoromethyl)quinoline31009-33-3MFCD11504912Quinoline, 4-bromo-6-fluoro-2-(trifluoromethyl)-NSC1425334-bromo-6-fluoro-2(trifluoromethyl)quinolineDTXSID40301346JMZGVHLYCHYQEH-UHFFFAOYSA-NAKOS015835387NSC-142533SB68810BS-22291
Show more names
CS-0450839G74880F215902
Database identifiers
- CAS
31009-33-3- PubChem CID
- 285541
- DTXSID
DTXSID40301346- Nikkaji
- J2.113.426K
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 258
Physicochemical properties
- Melting point
- 96 · 96-98 °C
- Boiling point
- 272.9 · 272.9±35.0 °C(Predicted)
- Density
- 1.722 · 1.722±0.06 g/cm3(Predicted)
- pka
- -2.07 · -2.07±0.50(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
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Compound notes
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