2-Fluorobenzyl chloride
Properties
- Molecular formula
- C7H6ClF
- Molar mass
- 144.57 g/mol
- Exact mass
- 144.0142 Da
- Density
- 1.2162 g/mL (at 24 °C)
- Melting point
- 36–38 °C
- Boiling point
- 86 °C
- logP
- 2.56Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 1
Hazards
Danger
- H226 Flammable liquid and vapor98.7% of notifiers
- H314 Causes severe skin burns and eye damage100% of notifiers
- H318 Causes serious eye damage67.7% of notifiers
- H400 Very toxic to aquatic life68.4% of notifiers
- H410 Very toxic to aquatic life with long lasting effects68.4% of notifiers
Aggregated from 155 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P260, P264, P264+P265, P273, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P363, P370+P378, P391, P403+P235, P405, P501
Identifiers
CAS number
345-35-7SMILES
Fc1ccccc1CClInChIKey
MOBRMRJUKNQBMY-UHFFFAOYSA-NInChI
InChI=1S/C7H6ClF/c8-5-6-3-1-2-4-7(6)9/h1-4H,5H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
8 names
- Benzene, 1-(chloromethyl)-2-fluoro-
- Toluene, α-chloro-o-fluoro-
- 1-(Chloromethyl)-2-fluorobenzene
- o-Fluorobenzyl chloride
- α-Chloro-2-fluorotoluene
- α-Chloro-o-fluorotoluene
- NSC 88295
- 2-Fluorophenylmethyl chloride
Work with 2-Fluorobenzyl chloride
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
2,3-Difluorobenzyl chloride446-57-165 % similar
α,α′-Dichloro-o-xylene612-12-462 % similar
2,6-Difluorobenzyl chloride697-73-456 % similar
2-Fluorobenzyl bromide446-48-054 % similar
2-Fluorobenzylic alcohol446-51-554 % similar
2-Fluorobenzylamine89-99-654 % similar
2,4-Difluorobenzyl chloride452-07-354 % similar
2,5-Difluorobenzyl chloride495-07-854 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.
Same formula
2-Chloro-1-fluoro-4-methylbenzene1513-25-3
1-Chloro-4-fluoro-2-methylbenzene33406-96-1
4-Fluorobenzyl chloride352-11-4
2-Chloro-6-fluorotoluene443-83-4
4-Chloro-1-fluoro-2-methylbenzene452-66-4
2-Chloro-4-fluoro-1-methylbenzene452-73-3
4-Chloro-2-fluoro-1-methylbenzene452-75-5
3-Fluorobenzyl chloride456-42-8