{"Aliases":["Nitrous acid, hexyl ester","n-Hexyl nitrite","Dtxcid70135737","680-102-5","Nitrous acid hexyl ester","Mfcd06797110","1-hexyl nitrite","Schembl1425927","BS-23578","DB-230519","H1066"],"CAS":"638-51-7","ChemicalClasses":["alkyl nitrite"],"Chirality":"achiral","DTXSID":"70213246","Erowid Experience Reports":[],"Esters":[],"European Community (EC) Number":"680-102-5","Formating":[],"HeavyAtomCount":9,"IUPACName":"hexyl nitrite","InChI":"InChI=1S/C6H13NO2/c1-2-3-4-5-6-9-7-8/h2-6H2,1H3","InChIKey":"SGRWGISGVDVSJV-UHFFFAOYSA-N","MeSH Headers":[],"MolecularFormula":"C\u003csub\u003e6\u003c/sub\u003eH\u003csub\u003e13\u003c/sub\u003eNO\u003csub\u003e2\u003c/sub\u003e","MolecularWeight":"131.17 g/mol","PubChemId":6365123,"PubChemTitle":"Nitrous acid, hexyl ester","Reddit Experience Reports":[],"RefChem":"854393","RefCount":2,"RefCur":"","References":[{"Name":"Wikipedia","Urls":[{"Link":"https://en.wikipedia.org/wiki/Hexyl_nitrite","Name":"Hexyl nitrite","Sub":false}]},{"Name":"Wikidata","Urls":[{"Link":"https://www.wikidata.org/wiki/Q83088537","Name":"Hexyl nitrite","Sub":false}]},{"Name":"PubChem","Urls":[{"Link":"https://pubchem.ncbi.nlm.nih.gov/compound/6365123","Name":"Hexyl nitrite","Sub":false}]},{"Name":"Common Chemistry","Urls":[{"Link":"https://commonchemistry.cas.org/detail?cas_rn=638-51-7","Name":"Hexyl nitrite","Sub":false}]},{"Name":"EPA DSSTox","Urls":[{"Link":"https://comptox.epa.gov/dashboard/chemical/details/DTXSID70213246","Name":"Hexyl nitrite","Sub":false}]}],"Refs":["National Center for Biotechnology Information. PubChem Compound Summary for CID 6365123, Hexyl nitrite. Accessed August 22, 2026. \u003ca href=https://pubchem.ncbi.nlm.nih.gov/compound/6365123\u003ehttps://pubchem.ncbi.nlm.nih.gov/compound/6365123\u003c/a\u003e"],"SMILES":"CCCCCCON=O","SaltData":[],"Salts":[],"StereoisomerData":[],"Stereoisomers":[],"Structure":"\u003csvg xmlns=\"http://www.w3.org/2000/svg\" preserveAspectRatio=\"none\" style=\"display:block\" viewBox=\"0 0 109.565 13.833\"\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=\"#ff0d0d\" stroke=\"#000\" stroke-linecap=\"round\" stroke-linejoin=\"round\" stroke-width=\".8\"\u003e\u003cpath fill=\"#fff\" stroke=\"none\" d=\"M0 0h110v14H0z\"/\u003e\u003cg class=\"mol\"\u003e\u003cpath d=\"m1.106 10.68 13.199-7.62M14.305 3.06l13.198 7.62M27.503 10.68l13.198-7.62M40.701 3.06l13.198 7.62M53.899 10.68l13.199-7.62M67.098 3.06l9.59 5.537M83.904 8.597l6.311-3.644\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m97.383 3.898 6.311 3.643M96.163 6.009l6.312 3.644\"/\u003e\u003cpath stroke=\"#3050f8\" d=\"m97.383 3.898 3.155 1.822\" class=\"hi\"/\u003e\u003cpath stroke=\"#ff0d0d\" d=\"m103.694 7.541-3.156-1.821\" class=\"hi\"/\u003e\u003cpath stroke=\"#3050f8\" d=\"m96.163 6.009 3.156 1.822\" class=\"hi\"/\u003e\u003cpath stroke=\"#ff0d0d\" d=\"m102.475 9.653-3.156-1.822\" class=\"hi\"/\u003e\u003c/g\u003e\u003cpath stroke=\"none\" d=\"M80.299 8.635q-.738 0-1.173.554-.429.548-.429 1.494 0 .947.429 1.495.435.547 1.173.547t1.167-.547q.428-.548.428-1.495 0-.946-.428-1.494-.429-.554-1.167-.554m0-.547q1.054 0 1.679.708.631.703.631 1.887 0 1.179-.631 1.887-.625.703-1.679.703t-1.685-.703-.631-1.887.631-1.887q.631-.708 1.685-.708\" class=\"atom\"/\u003e\u003cpath fill=\"#3050f8\" stroke=\"none\" d=\"M91.601.56h.911l2.214 4.185V.56h.661v5.001h-.911l-2.22-4.185v4.185h-.655z\" class=\"atom\"/\u003e\u003cpath stroke=\"none\" d=\"M106.695 8.635q-.738 0-1.172.554-.429.548-.429 1.494 0 .947.429 1.495.434.547 1.172.547t1.167-.547.429-1.495q0-.946-.429-1.494-.429-.554-1.167-.554m0-.547q1.054 0 1.679.708.631.703.631 1.887 0 1.179-.631 1.887-.625.703-1.679.703-1.053 0-1.684-.703-.631-.702-.631-1.887 0-1.184.631-1.887.631-.708 1.684-.708\" class=\"atom\"/\u003e\u003cpath stroke=\"#ff0d0d\" d=\"m76.688 8.597-4.795-2.768M83.904 8.597l3.155-1.822\" class=\"hi\"/\u003e\u003cpath stroke=\"#3050f8\" d=\"m90.215 4.953-3.156 1.822\" class=\"hi\"/\u003e\u003c/g\u003e\u003c/g\u003e\u003c/svg\u003e","Title":"Hexyl nitrite","Wikidata":"Q83088537","Wikipedia":"Hexyl_nitrite","XLogP":2.4}