2,4-Difluoroaniline
Properties
- Molecular formula
- C6H5F2N
- Molar mass
- 129.11 g/mol
- Exact mass
- 129.0390 Da
- Density
- 1.268 g/mL
- Melting point
- −7.5 °C
- Boiling point
- 170 °C
- Flash point
- 62.8 °C
- Water solubility
- 10–50 g/L (20.5 °C)
- logP
- 1.55Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H302 Harmful if swallowed99.4% of notifiers
- H311+H331 Toxic in contact with skin or if inhaled.66.2% of notifiers
- H311 Toxic in contact with skin97.5% of notifiers
- H315 Causes skin irritation71.3% of notifiers
- H319 Causes serious eye irritation70.7% of notifiers
- H331 Toxic if inhaled96.8% of notifiers
- H335 May cause respiratory irritation66.2% of notifiers
- H400 Very toxic to aquatic life67.5% of notifiers
- H410 Very toxic to aquatic life with long lasting effects68.2% of notifiers
Aggregated from 157 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P391, P403+P233, P405, P501
Identifiers
CAS number
367-25-9SMILES
Nc1ccc(F)cc1FInChIKey
CEPCPXLLFXPZGW-UHFFFAOYSA-NInChI
InChI=1S/C6H5F2N/c7-4-1-2-6(9)5(8)3-4/h1-3H,9H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- Benzenamine, 2,4-difluoro-
- Aniline, 2,4-difluoro-
- 2,4-Difluorobenzenamine
- 2,4-Difluorophenylamine
- NSC 10297
Work with 2,4-Difluoroaniline
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
4-Fluoro-1,2-phenylenediamine367-31-765 % similar
4-Fluoro-2-methoxyaniline450-91-957 % similar
1,2,4-Trifluorobenzene367-23-757 % similar
2-Bromo-4-fluoroaniline1003-98-156 % similar
2-Chloro-4-fluorobenzenamine2106-02-756 % similar
2-Fluoro-4-iodoaniline29632-74-456 % similar
4-Bromo-2-fluoroaniline367-24-856 % similar
4-Amino-3-fluorophenol399-95-156 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.