4-Fluorophenethylamine

C₈H₁₀FNCAS 1583-88-6139.17 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₈H₁₀FN
Molar mass: 139.17 g/mol
Exact mass: 139.0797 Da
Density: 1.069 g/mL (at 20 °C)
Boiling point: 99–100 °C (at 24 Torr)
logP: 1.33Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Hazards

Danger

H301 Toxic if swallowed93.2% of notifiers
H311 Toxic in contact with skin93.2% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H331 Toxic if inhaled90.9% of notifiers

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P262, P264, P270, P271, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P361+P364, P363, P403+P233, P405, P501

Identifiers

CAS number

1583-88-6

SMILES

NCCc1ccc(F)cc1

InChIKey

CKLFJWXRWIQYOC-UHFFFAOYSA-N

InChI

InChI=1S/C8H10FN/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5-6,10H2

Weigh it out

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

Names and synonyms

10 names

Benzeneethanamine, 4-fluoro-
Phenethylamine, p-fluoro-
4-Fluorobenzeneethanamine
2-(p-Fluorophenyl)ethylamine
p-Fluorophenethylamine
2-(4-Fluorophenyl)ethylamine
(p-Fluorophenyl)ethylamine
2-(4-Fluorophenyl)ethanamine
4-(2-Aminoethyl)fluorobenzene
2-(4-Fluorophenyl)ethan-1-amine

Work with 4-Fluorophenethylamine

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

3-Fluorophenethylamine404-70-662 % similar 4-Fluorobenzylamine140-75-061 % similar 1,1′-Methylenebis[4-fluorobenzene]457-68-155 % similar 2-(4-Aminophenyl)ethylamine13472-00-954 % similar Benzeneethanamine64-04-052 % similar 2-(4-Chlorophenyl)ethylamine156-41-252 % similar 4-Methylphenethylamine3261-62-952 % similar 1-(2-Bromoethyl)-4-fluorobenzene332-42-352 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

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 1-(4-Fluorophenyl)ethylamine403-40-7

Elsewhere

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