benzylamine

GPTKB entity

Statements (27)
Predicate Object
gptkbp:instanceOf gptkb:chemical_compound
primary amine
gptkbp:appearance colorless liquid
gptkbp:aroma ammonia-like
gptkbp:boilingPoint 185 °C
gptkbp:CASNumber 100-46-9
gptkbp:category aromatic amines
benzyl compounds
gptkbp:chemicalFormula C7H9N
gptkbp:density 0.981 g/cm³
gptkbp:hasInChIKey InChI=1S/C7H9N/c8-6-7-4-2-1-3-5-7/h1-5H,6,8H2
gptkbp:hasSMILES c1ccccc1CN
https://www.w3.org/2000/01/rdf-schema#label benzylamine
gptkbp:IUPACName phenylmethanamine
gptkbp:meltingPoint -30 °C
gptkbp:molecularWeight 107.16 g/mol
gptkbp:pKa 9.33 (conjugate acid)
gptkbp:riskFactor irritant
gptkbp:solubility soluble in ethanol
soluble in ether
miscible
gptkbp:structure contains a benzyl group attached to an amino group
gptkbp:uses intermediate in organic synthesis
precursor to pharmaceuticals
gptkbp:bfsParent gptkb:MAO-B
gptkb:monoamine_oxidase_B
gptkbp:bfsLayer 7