2-Fluoro-N-methylbenzenamine

C₇H₈FNCAS 1978-38-7125.15 g/mol

Open in Covalent MOL file

Aryl halide Secondary amine

Properties

Molecular formula: C₇H₈FN
Molar mass: 125.15 g/mol
Exact mass: 125.0641 Da
logP: 1.87Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Danger

H227 Combustible liquid25% of notifiers
H301 Toxic if swallowed25% of notifiers
H302 Harmful if swallowed50% of notifiers
H312 Harmful in contact with skin25% of notifiers
H315 Causes skin irritation75% of notifiers
H318 Causes serious eye damage25% of notifiers
H319 Causes serious eye irritation75% of notifiers
H332 Harmful if inhaled25% of notifiers
H335 May cause respiratory irritation50% of notifiers

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, P501

Identifiers

CAS number

1978-38-7

SMILES

CNc1ccccc1F

InChIKey

LDVAIJZDACHGML-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

6 names

Benzenamine, 2-fluoro-N-methyl-
Aniline, o-fluoro-N-methyl-
N-Methyl-o-fluoroaniline
2-Fluoro-N-methylaniline
N-Methyl-2-fluoroaniline
N-(2-Fluorophenyl)methylamine

Work with 2-Fluoro-N-methylbenzenamine

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

(2-Fluorophenyl)hydrazine2368-80-156 % similar 2,4-Difluoro-N-methylaniline138564-16-654 % similar N-Ethyl-2-fluorobenzenamine2707-64-454 % similar Hydrazine, (2-fluorophenyl)-, hydrochloride (1:1)2924-15-450 % similar N-Methyl-o-toluidine611-21-250 % similar N-Methyl-2-(trifluoromethyl)benzenamine14925-10-148 % similar N-Methyl-1,2-phenylenediamine4760-34-348 % similar 2-(Methylamino)phenol611-24-548 % 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 5-Fluoro-2-methylaniline367-29-3 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