(R)-1-(3-Fluorophenyl)ethanamine

C₈H₁₀FNCAS 761390-58-3139.17 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
logP: 1.85Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1
Stereocentres: Rin SMILES atom order

Hazards

Danger

H314 Causes severe skin burns and eye damage33.3% of notifiers
H315 Causes skin irritation66.7% of notifiers
H319 Causes serious eye irritation66.7% of notifiers
H335 May cause respiratory irritation66.7% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, P501

Identifiers

CAS number

761390-58-3

SMILES

C[C@H](C1=CC(=CC=C1)F)N

InChIKey

ASNVMKIDRJZXQZ-ZCFIWIBFSA-N

InChI

InChI=1S/C8H10FN/c1-6(10)7-3-2-4-8(9)5-7/h2-6H,10H2,1H3/t6-/m1/s1

Weigh it out

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

Names and synonyms

1 names

(R)-1-(3-Fluorophenyl)ethylamine

Work with (R)-1-(3-Fluorophenyl)ethanamine

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

1-(4-Fluorophenyl)ethylamine403-40-761 % similar (S)-1-(4-Fluorophenyl)-ethylamine66399-30-261 % similar (S)-1-(3-Bromophenyl)ethylamine139305-96-758 % similar (R)-1-(3-Bromophenyl)ethanamine176707-77-058 % similar (R)-1-[3-(Trifluoromethyl)phenyl]ethylamine127852-30-658 % similar (S)-α-Phenethylamine2627-86-356 % similar (R)-α-Phenethylamine3886-69-956 % similar 1-Phenethylamine618-36-056 % 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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