3-Fluoro-4-methylbenzenemethanamine

C8H10FNCAS 261951-67-1139.17 g/mol

Open in Covalent MOL file
NH2F
Aryl halidePrimary amine

Properties

Molecular formula
C8H10FN
Molar mass
139.17 g/mol
Exact mass
139.0797 Da
logP
1.59Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number
261951-67-1
SMILES
Cc1ccc(CN)cc1F
InChIKey
XCAJNBJDLZPHNB-UHFFFAOYSA-N
InChI
InChI=1S/C8H10FN/c1-6-2-3-7(5-10)4-8(6)9/h2-4H,5,10H2,1H3

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Names and synonyms

3 names
  • Benzenemethanamine, 3-fluoro-4-methyl-
  • 3-Fluoro-4-methylbenzylamine
  • (3-Fluoro-4-methylphenyl)methanamine

Work with 3-Fluoro-4-methylbenzenemethanamine

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

3,4-Dimethylbenzenemethanamine102-48-764 % similar 3,4-Difluorobenzylamine72235-53-164 % similar 3-Fluoro-4-methylbenzyl bromide145075-44-161 % similar 3-Fluoro-4-methylbenzyl alcohol192702-79-761 % similar 3-Chloro-4-methylbenzylamine67952-93-656 % similar (4-Chloro-3-fluorophenyl)methanamine72235-58-656 % similar 3-Fluoro-4-(trifluoromethyl)benzylamine235106-09-953 % similar 3-Fluoro-4-methylaniline452-77-752 % 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 (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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