2,6-Dibromo-4-fluoropyridine
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Basic information
- CAS
1214344-15-6- Standard SMILES
Fc1cc(Br)nc(Br)c1- InChIKey
VMKXRAUUPMNAOQ-UHFFFAOYSA-N- Molecular formula
- C5H2Br2FN
- Average molar mass
- 254.88 g/mol
- Monoisotopic mass
- 252.8538
Names & identifiers
- Preferred name
- 2,6-Dibromo-4-fluoropyridine
- IUPAC
- 2,6-dibromo-4-fluoropyridine
- English name
- 2,6-DIBROMO-4-FLUOROPYRIDINE
- Molecular formula
- C5H2Br2FN
- Molecular weight
- 254.88
Names & synonyms
2,6-Dibromo-4-fluoropyridine1214344-15-6Pyridine, 2,6-dibromo-4-fluoro-MFCD13185514Dibromo-4-fluoropyridine2,6-dibromo-4-fluoro-pyridineSCHEMBL17963964AKOS027324669SB52222DS-11535SY270235DB-250888
Show more names
CS-0060160O10624F603179
Database identifiers
- CAS
1214344-15-6- PubChem CID
- 92134871
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 91
Physicochemical properties
- Boiling point
- 249.5 · 249.5±35.0 °C(Predicted)
- Density
- 2.137 · 2.137±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- -4.78 · -4.78±0.10(Predicted)
- form
- solid
- color
- Yellow
- InChI
- InChI=1S/C5H2Br2FN/c6-4-1-3(8)2-5(7)9-4/h1-2H
- InChIKey
- VMKXRAUUPMNAOQ-UHFFFAOYSA-N
- SMILES
- C1(Br)=NC(Br)=CC(F)=C1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2933399990 · 2933399990
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
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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