4-Fluoro-N,N-dimethylaniline

C₈H₁₀FNCAS 403-46-3139.17 g/mol

Open in Covalent MOL file

Aryl halide Tertiary amine

Properties

Molecular formula: C₈H₁₀FN
Molar mass: 139.17 g/mol
Exact mass: 139.0797 Da
logP: 1.89Crippen estimate
Polar surface area: 3.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

403-46-3

SMILES

CN(C)C1=CC=C(C=C1)F

InChIKey

YJEHCGOJNJUOII-UHFFFAOYSA-N

InChI

InChI=1S/C8H10FN/c1-10(2)8-5-3-7(9)4-6-8/h3-6H,1-2H3

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Names and synonyms

1 names

N,N-Dimethyl-4-fluoroaniline

Work with 4-Fluoro-N,N-dimethylaniline

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

Wurster's blue100-22-167 % similar N,N,N',N'-Tetramethylbenzidine366-29-057 % similar Tetramethyl-p-phenylenediamine dihydrochloride637-01-457 % similar Dimethyl-p-toluidine99-97-852 % similar Tetramethyldiaminodiphenylmethane101-61-150 % similar Dimethylaniline121-69-750 % similar 1,4-Difluorobenzene540-36-350 % similar 4-Bromo-N′,N′-dimethylaniline586-77-650 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Fluorophenethylamine1583-88-6 4-Fluoro-3,5-dimethylaniline1840-27-3 3-Fluoro-4-methylbenzenemethanamine261951-67-1 (4-Fluoro-3-methylphenyl)methanamine261951-68-2 5-Fluoro-2-methylbenzenemethanamine261951-69-3 N-Ethyl-2-fluorobenzenamine2707-64-4 (+)-1-(4-Fluorophenyl)ethylamine374898-01-8 2-Fluoro-N-methylbenzylamine399-30-4

Elsewhere

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