1,3-Dibromo-5-fluorobenzene
Properties
- Molecular formula
- C6H3Br2F
- Molar mass
- 253.90 g/mol
- Exact mass
- 251.8586 Da
- Boiling point
- 204–206 °C
- logP
- 3.35Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation77.8% of notifiers
Aggregated from 9 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1435-51-4SMILES
Fc1cc(Br)cc(Br)c1InChIKey
ASWYHZXKFSLNLN-UHFFFAOYSA-NInChI
InChI=1S/C6H3Br2F/c7-4-1-5(8)3-6(9)2-4/h1-3HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Benzene, 1,3-dibromo-5-fluoro-
- 3,5-Dibromofluorobenzene
- 3,5-Dibromo-1-fluorobenzene
- 1-Fluoro-3,5-dibromobenzene
Work with 1,3-Dibromo-5-fluorobenzene
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
1-Bromo-3,5-difluorobenzene461-96-188 % similar
3-Bromo-5-fluoroaniline134168-97-164 % similar
1-Bromo-3-fluoro-5-methylbenzene202865-83-664 % similar
1-Bromo-3-chloro-5-fluorobenzene33863-76-264 % similar
3-Bromo-5-fluorophenol433939-27-664 % similar
3-Fluoro-5-iodo bromobenzene845866-85-564 % similar
1,3,5-Tribromobenzene626-39-160 % similar
3-Bromo-5-fluorobenzotrifluoride130723-13-658 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.