5-Fluoro-2-methylaniline

C₇H₈FNCAS 367-29-3125.15 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₇H₈FN
Molar mass: 125.15 g/mol
Exact mass: 125.0641 Da
Melting point: 37.5 °C
Boiling point: 100–101 °C (at 16 Torr)
logP: 1.72Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

Danger

H302 Harmful if swallowed98% of notifiers
H311 Toxic in contact with skin10.2% of notifiers
H312 Harmful in contact with skin89.8% of notifiers
H315 Causes skin irritation98% of notifiers
H319 Causes serious eye irritation98% of notifiers
H332 Harmful if inhaled98% of notifiers
H335 May cause respiratory irritation83.7% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure16.3% of notifiers

Aggregated from 49 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

367-29-3

SMILES

Cc1ccc(F)cc1N

InChIKey

JLCDTNNLXUMYFQ-UHFFFAOYSA-N

InChI

InChI=1S/C7H8FN/c1-5-2-3-6(8)4-7(5)9/h2-4H,9H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names

Benzenamine, 5-fluoro-2-methyl-
o-Toluidine, 5-fluoro-
5-Fluoro-2-methylbenzenamine
2-Methyl-5-fluoroaniline
2-Amino-4-fluorotoluene
3-Fluoro-6-methylaniline
NSC 60730
5-Fluoro-2-methylphenylamine
5-Fluoro-o-toluidine

Work with 5-Fluoro-2-methylaniline

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Fluoro-2-methylaniline452-71-169 % similar 4-Fluoro-1,2-phenylenediamine367-31-760 % similar 4-Fluoro-1,2-dimethylbenzene452-64-260 % similar 5-Fluoro-2-iodoaniline255724-71-157 % similar 2,5-Difluoroaniline367-30-656 % similar 2,4-Difluoro-1-methylbenzene452-76-656 % similar 2,5-Xylidine95-78-356 % similar 2,4-Diaminotoluene95-80-756 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Fluorobenzylamine100-82-3 4-Fluorobenzylamine140-75-0 2-Fluoro-3-methylaniline1978-33-2 3-Fluoro-N-methylaniline1978-37-6 2-Fluoro-N-methylbenzenamine1978-38-7 3-Fluoro-2-methylaniline443-86-7 2-Fluoro-6-methylaniline443-89-0 4-Fluoro-3-methylaniline452-69-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook