1-Chloro-2-fluorobenzene
Properties
- Molecular formula
- C6H4ClF
- Molar mass
- 130.55 g/mol
- Exact mass
- 129.9986 Da
- Density
- 1.2346 g/mL (at 25 °C)
- Melting point
- −43 °C
- Boiling point
- 137.6 °C
- logP
- 2.48Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Hazards
Warning
- H226 Flammable liquid and vapor94.2% of notifiers
- H315 Causes skin irritation92.3% of notifiers
- H319 Causes serious eye irritation92.3% of notifiers
- H332 Harmful if inhaled15.4% of notifiers
- H335 May cause respiratory irritation11.5% of notifiers
Aggregated from 52 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
348-51-6SMILES
Fc1ccccc1ClInChIKey
ZCJAYDKWZAWMPR-UHFFFAOYSA-NInChI
InChI=1S/C6H4ClF/c7-5-3-1-2-4-6(5)8/h1-4HWeigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
9 names
- Benzene, 1-chloro-2-fluoro-
- o-Chlorofluorobenzene
- 1-Fluoro-2-chlorobenzene
- o-Fluorochlorobenzene
- 2-Chlorofluorobenzene
- o-Monofluoromonochlorobenzene
- 2-Fluoro-1-chlorobenzene
- NSC 10270
- 2-Fluorophenyl chloride
Work with 1-Chloro-2-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
1,2-Dichloro-3-fluorobenzene36556-50-064 % similar
1-Chloro-3-fluoro-2-iodobenzene127654-70-058 % similar
2-Chloro-6-fluorophenol2040-90-658 % similar
2-Bromo-1-chloro-3-fluorobenzene309721-44-658 % similar
2-Chloro-6-fluoroaniline363-51-958 % similar
2-Chloro-6-fluorotoluene443-83-458 % similar
2-Chloro-6-fluorobenzonitrile668-45-158 % similar
1,2-Difluorobenzene367-11-356 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.