75502 <common-name>N-Benzyl-4-toluidine</common-name> <description>N-Benzyl-4-toluidine belongs to the phenylmethylamines, a subclass of benzene and substituted derivatives within the organic compounds. It is a member of the benzenoids superclass with the formula C14H15N1. The compound has an average molecular weight of 197.28 g/mol.</description> <cas>5405-15-2</cas> <pubchem-id>79403</pubchem-id> <chemical-formula>C14H15N1</chemical-formula> <weight>197.27</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-04-04T04:18:49Z</created-at> <updated-at type="dateTime">2026-08-19T05:41:21Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>CC1=CC=C(NCC2=CC=CC=C2)C=C1</moldb-smiles> <moldb-formula>C14H15N1</moldb-formula> <moldb-inchi>InChI=1S/C14H15N/c1-12-7-9-14(10-8-12)15-11-13-5-3-2-4-6-13/h2-10,15H,11H2,1H3</moldb-inchi> <moldb-inchikey>KEVOWRWHMCBERP-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">197.281</moldb-average-mass> <moldb-mono-mass type="decimal">197.120449</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.5</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>71722</chemspider-id> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM071395</chemdb-id> <dsstox-id>DTXSID10202376</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00032929</susdat-id> <iupac>N-benzyl-4-methylaniline</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Phenylmethylamines</subklass> <paper-count type="integer">1</paper-count> <sync-id>CED0070256</sync-id> <structure-inchikey>KEVOWRWHMCBERP-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20000810000000000000000000000000100000000001000010000000000000000000000000000000004000000000000000000000000000000000000000000000000000000000000020000000000000000000000000000000000000000000000000010000000000000000000000000000000000000000000000000000040200000800000000000000080000000000100000000000000000000000000000000000000000000080000000080000000000000000000000000000000000000000000000000000000000000000000000000002000000220000000000000000100000000000040000000000080000000000000000000080000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAPAAAAEAAAAIABBgBgAAAAAQMGQCgAAAAD BAZAaAAAAAMDAQZAaAAAAAMDAQZAKAAAAAMEBwBoAAAAAwIBBgBgAAAAAgIG QCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZA aAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQsAAQABAmgMAgNoDAMEaAwEBSAF BgAGBwAHCGgMCAloDAkKaAwKC2gMCwxoDAQNaAwNDmgMDgFoDAwHaAxCAgAA AAYBDg0EAwIGCAkKCwwHFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:23:45Z</structure-indexed-at> </compound>