{"Abbreviation":["4-MBC"],"Aliases":["4-Methyl-N-benzylcathinone","4-MBC","4-Mbc","1-(4-Methylphenyl)-2-((phenylmethyl)amino)-1-propanone","1-Propanone, 1-(4-methylphenyl)-2-((phenylmethyl)amino)-","Dtxcid701475287","1-(4-Methylphenyl)-2-(benzylamino)propan-1-one","1-(4-Methylphenyl)-2-(benzylaMino)propan-1-one","Schembl30559566","AZB61775","s11836","2-(Benzylamino)-1-(p-tolyl)propan-1-one","NS00015376","T207289"],"CAS":"1225617-75-3","ChemicalClasses":["cathinone"],"Chirality":"racemic","DTXSID":"401017094","EliminationHalfLife":"","Esters":[],"Formating":[],"HeavyAtomCount":19,"IUPACName":"2-(benzylamino)-1-(4-methylphenyl)propan-1-one","InChI":"InChI=1S/C17H19NO/c1-13-8-10-16(11-9-13)17(19)14(2)18-12-15-6-4-3-5-7-15/h3-11,14,18H,12H2,1-2H3","InChIKey":"KWHZRPBDEAQYDE-UHFFFAOYSA-N","MeSH Headers":[],"MolecularFormula":"C\u003csub\u003e17\u003c/sub\u003eH\u003csub\u003e19\u003c/sub\u003eNO","MolecularWeight":"253.34 g/mol","Opticalactivity":"( + / - )","PubChemId":57493771,"PubChemTitle":"Benzedrone","Record Description":["Wikipedia|List of designer drugs|Stimulants|Cathinones"],"Records":{"UNII":{"Impurities":[]}},"RefChem":"117188","RefCount":2,"References":[{"Name":"Wikipedia","Urls":[{"Link":"https://en.wikipedia.org/wiki/Benzedrone","Name":"Benzedrone","Sub":false}]},{"Name":"Wikidata","Urls":[{"Link":"https://www.wikidata.org/wiki/Q4890752","Name":"Benzedrone","Sub":false}]},{"Name":"PubChem","Urls":[{"Link":"https://pubchem.ncbi.nlm.nih.gov/compound/57493771","Name":"Benzedrone","Sub":false}]},{"Name":"Common Chemistry","Urls":[{"Link":"https://commonchemistry.cas.org/detail?cas_rn=1225617-75-3","Name":"Benzedrone","Sub":false}]},{"Name":"UNII","Urls":[{"Link":"https://gsrs.ncats.nih.gov/ginas/app/ui/substances/V6Z5G5VE87","Name":"Benzedrone","Sub":false}]},{"Name":"EPA DSSTox","Urls":[{"Link":"https://comptox.epa.gov/dashboard/chemical/details/DTXSID401017094","Name":"Benzedrone","Sub":false}]}],"Refs":["National Center for Biotechnology Information. PubChem Compound Summary for CID 57493771, Benzedrone. Accessed October 14, 2026. \u003ca href='https://pubchem.ncbi.nlm.nih.gov/compound/57493771'\u003ehttps://pubchem.ncbi.nlm.nih.gov/compound/57493771\u003c/a\u003e","U.S. Food and Drug Administration; National Center for Advancing Translational Sciences. Benzedrone. UNII: V6Z5G5VE87. Global Substance Registration System. Accessed October 14, 2026. \u003ca href=https://gsrs.ncats.nih.gov/ginas/app/beta/substances/V6Z5G5VE87\u003ehttps://gsrs.ncats.nih.gov/ginas/app/beta/substances/V6Z5G5VE87\u003c/a\u003e"],"SMILES":"CC1=CC=C(C=C1)C(=O)C(C)NCC2=CC=CC=C2","SaltData":[],"Salts":[],"Scheduling":[{"act":"Neue-psychoaktive-Stoffe-Gesetz (NpSG)","gov":"Germany","ref":[],"schedule":"Neuer-Psychoaktiver-Stoff"},{"gov":"United Kingdom","ref":[],"schedule":"Class B substance"}],"StereoisomerData":[{"ChemicalClasses":["cathinone"],"SMILES":"CC1=CC=C(C(=O)[C@H](C)NCC2=CC=CC=C2)C=C1","Structure":"\u003csvg xmlns=\"http://www.w3.org/2000/svg\" preserveAspectRatio=\"none\" style=\"display:block\" viewBox=\"0 0 134.2 55.57\"\u003e\u003crect width=\"100%\" height=\"100%\" fill=\"#fff\"/\u003e\u003cdesc\u003eGenerated by the Chemistry Development Kit (http://github.com/cdk)\u003c/desc\u003e\u003cg fill=\"#3050f8\" stroke=\"#000\" stroke-linecap=\"round\" stroke-linejoin=\"round\" stroke-width=\".8\"\u003e\u003cpath 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stroke=\"none\" d=\"M53.902 6.69q-.738 0-1.172.554-.429.547-.429 1.494t.429 1.494q.434.548 1.172.548.739 0 1.167-.548.429-.547.429-1.494t-.429-1.494q-.428-.554-1.167-.554m0-.548q1.054 0 1.679.709.631.702.631 1.887 0 1.179-.631 1.887-.625.703-1.679.703-1.053 0-1.684-.703-.631-.702-.631-1.887t.631-1.887q.631-.709 1.684-.709\" class=\"atom\"/\u003e\u003cg stroke=\"none\" class=\"atom\"\u003e\u003cpath d=\"M78.403 21.475h.911l2.214 4.185v-4.185h.661v5h-.911l-2.22-4.185v4.185h-.655zM78.403 15.903h.678v2.047h2.459v-2.047h.673v5h-.673v-2.381h-2.459v2.381h-.678z\"/\u003e\u003c/g\u003e\u003cpath stroke=\"#3050f8\" d=\"m77.017 25.868-4.959 2.863M83.581 25.872l4.956 2.861\" class=\"hi\"/\u003e\u003c/g\u003e\u003c/g\u003e\u003c/svg\u003e","Title":"Benzedrone","UNII":"V6Z5G5VE87","Wikidata":"Q4890752","Wikipedia":"Benzedrone","XLogP":3.5}
