{"Abbreviation":["1,3-BDO"],"Aliases":["1,3-Butanediol","Butane-1,3-diol","1,3-Butylene glycol","Butylene glycol","1,3-Dihydroxybutane","Methyltrimethylene glycol","1,3 Butylene glycol","1,3-Butandiol","β-Butylene glycol","1-Methyl-1,3-propanediol","1,3-Butylenglykol","Caswell No. 128GG","AI3-11077","Herbal Moxibustion","Chinese medicine patch","MUMMY MASK","GlyTouCan:G07075BD","3% Hyaluronic Acid Serum","Natural Oriental Herb Care","Srripo Biotin Hair Treatment","acmeros Lubricant X0026F3541","ShiZhenTaiYiTang Moxibustion Patch","LingLongJiuHuo Linglong Moxibustion","QIZHOUGUAI Chinese medicine patch","G07075BD"],"Boiling Point":"207.5 °C","CAS":"107-88-0","ChEBI":"CHEBI:52683","ChEMBL":"CHEMBL3186475","ChemicalClasses":[],"Chirality":"racemic","Color/Form":"Viscous liquid","Decomposition":"When heated to decomposition it emits acrid smoke and irritating fumes.","Density":"1.0053 g/cu cm at 20 °C g/cm\u003csup\u003e3\u003c/sup\u003e","EINECS":"203-529-7","Erowid Experience Reports":[],"Esters":[],"European Community (EC) Number":"203-529-7","Flash Point":"121 °C","Formating":[],"HMDB ID":"HMDB0031320","HeavyAtomCount":6,"IUPACName":"butane-1,3-diol","InChI":"InChI=1S/C4H10O2/c1-4(6)2-3-5/h4-6H,2-3H2,1H3","InChIKey":"PUPZLCDOIYMWBV-UHFFFAOYSA-N","Melting Point":"\u003c -50 °C","MolecularFormula":"C\u003csub\u003e4\u003c/sub\u003eH\u003csub\u003e10\u003c/sub\u003eO\u003csub\u003e2\u003c/sub\u003e","MolecularWeight":"90.12 g/mol","Odor":"Practically odorless","Physical Description":"Liquid","PubChemId":7896,"RefCount":2,"RefCur":"","References":[{"Name":"Wikipedia","Urls":[{"Link":"https://en.wikipedia.org/wiki/1,3-Butanediol","Name":"1,3-Butanediol","Sub":false}]},{"Name":"DrugBank","Urls":[{"Link":"https://go.drugbank.com/drugs/DB14110","Name":"1,3-Butanediol","Sub":false}]},{"Name":"PubChem","Urls":[{"Link":"https://pubchem.ncbi.nlm.nih.gov/compound/7896","Name":"1,3-Butanediol","Sub":false}]},{"Name":"ChEMBL","Urls":[{"Link":"https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3186475","Name":"1,3-Butanediol","Sub":false}]},{"Name":"ChEBI","Urls":[{"Link":"https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:52683","Name":"1,3-Butanediol","Sub":false}]},{"Name":"Common Chemistry","Urls":[{"Link":"https://commonchemistry.cas.org/detail?cas_rn=107-88-0","Name":"1,3-Butanediol","Sub":false}]},{"Name":"HMDB","Urls":[{"Link":"https://hmdb.ca/metabolites/HMDB0031320","Name":"1,3-Butanediol","Sub":false}]},{"Name":"KEGG","Urls":[{"Link":"https://www.kegg.jp/entry/C20335","Name":"1,3-Butanediol","Sub":false}]},{"Name":"UNII","Urls":[{"Link":"https://gsrs.ncats.nih.gov/ginas/app/ui/substances/3XUS85K0RA","Name":"1,3-Butanediol","Sub":false}]},{"Name":"EPA DSSTox","Urls":[{"Link":"https://comptox.epa.gov/dashboard/chemical/details/DTXSID8026773","Name":"1,3-Butanediol","Sub":false}]}],"Refs":["National Center for Biotechnology Information. PubChem Compound Summary for CID 7896, 1,3-Butanediol. Accessed July 28, 2025. \u003ca href=https://pubchem.ncbi.nlm.nih.gov/compound/7896\u003ehttps://pubchem.ncbi.nlm.nih.gov/compound/7896\u003c/a\u003e"],"SMILES":"CC(CCO)O","SaltData":[],"Salts":[],"Solubility":"Miscible with water","StereoisomerData":[{"Aliases":null,"PubChemId":null,"SMILES":"C[C@@H](O)CCO","Structure":"\u003csvg xmlns=\"http://www.w3.org/2000/svg\" preserveAspectRatio=\"none\" style=\"display:block\" viewBox=\"0 0 60.956 29.022\"\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=\".7\"\u003e\u003cpath fill=\"#fff\" stroke=\"none\" d=\"M0 0h61v30H0z\"/\u003e\u003cg class=\"mol\"\u003e\u003cpath d=\"m59.918 25.941-13.198-7.62\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"M46.37 18.321h.7\"/\u003e\u003cpath stroke=\"#ff0d0d\" 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stroke=\"none\" d=\"M0 0h61v30H0z\"/\u003e\u003cg class=\"mol\"\u003e\u003cpath d=\"m59.918 25.941-13.198-7.62\" class=\"bond\"/\u003e\u003cpath fill=\"#000\" stroke=\"none\" d=\"M46.37 18.321h.7l1.3-11.319h-3.3z\" class=\"bond\"/\u003e\u003cpath d=\"m46.72 18.321-13.198 7.62M33.522 25.941l-13.198-7.62M20.324 18.321l-9.92 5.727\" class=\"bond\"/\u003e\u003cg stroke=\"none\" class=\"atom\"\u003e\u003cpath d=\"M48.979 3.078q0 .756-.256 1.328-.256.565-.756.881-.5.315-1.244.315-.756 0-1.262-.315-.506-.316-.756-.887-.244-.572-.244-1.334 0-.75.244-1.309.25-.566.756-.881T46.735.56q.732 0 1.232.316.5.309.756.875.256.565.256 1.327m-3.863 0q0 .923.387 1.459.393.53 1.22.53.839 0 1.22-.53.387-.536.387-1.459 0-.929-.387-1.452-.381-.524-1.208-.524-.833 0-1.226.524-.393.523-.393 1.452M53.285 5.531h-.619V3.245h-2.512v2.286h-.613v-4.9h.613v2.072h2.512V.631h.619z\"/\u003e\u003c/g\u003e\u003cg stroke=\"none\" class=\"atom\"\u003e\u003cpath d=\"M9.385 25.938q0 .756-.256 1.328-.256.565-.756.881-.5.315-1.245.315-.756 0-1.262-.315-.506-.316-.756-.887-.244-.572-.244-1.334 0-.75.244-1.309.25-.566.756-.881t1.274-.316q.733 0 1.233.316.5.309.756.875.256.565.256 1.327m-3.864 0q0 .923.387 1.459.393.53 1.22.53.84 0 1.221-.53.387-.536.387-1.459 0-.929-.387-1.452-.381-.524-1.209-.524-.833 0-1.226.524-.393.523-.393 1.452M4.305 28.391h-.62v-2.286H1.173v2.286H.56v-4.9h.613v2.072h2.512v-2.072h.62z\"/\u003e\u003c/g\u003e\u003cpath stroke=\"#ff0d0d\" d=\"m10.404 24.048 4.96-2.864M10.404 24.048l4.96-2.864\" class=\"hi\"/\u003e\u003c/g\u003e\u003c/g\u003e\u003c/svg\u003e","Title":"(S)-1,3-Butanediol","UNII":null}],"StereoisomerType":"enantiomer","Stereoisomers":["(R)-1,3-Butanediol","(S)-1,3-Butanediol"],"Structure":"\u003csvg xmlns=\"http://www.w3.org/2000/svg\" preserveAspectRatio=\"none\" style=\"display:block\" viewBox=\"0 0 60.956 29.022\"\u003e\u003crect width=\"100%\" height=\"100%\" fill=\"#fff\"/\u003e\u003cdesc\u003eGenerated by the Chemistry Development Kit 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d=\"M48.979 3.078q0 .756-.256 1.328-.256.565-.756.881-.5.315-1.244.315-.756 0-1.262-.315-.506-.316-.756-.887-.244-.572-.244-1.334 0-.75.244-1.309.25-.566.756-.881T46.735.56q.732 0 1.232.316.5.309.756.875.256.565.256 1.327m-3.863 0q0 .923.387 1.459.393.53 1.22.53.839 0 1.22-.53.387-.536.387-1.459 0-.929-.387-1.452-.381-.524-1.208-.524-.833 0-1.226.524-.393.523-.393 1.452M53.285 5.531h-.619V3.245h-2.512v2.286h-.613v-4.9h.613v2.072h2.512V.631h.619z\"/\u003e\u003c/g\u003e\u003cpath stroke=\"#ff0d0d\" d=\"m10.404 24.048 4.96-2.864M10.404 24.048l4.96-2.864M46.72 7.002v5.66M46.72 7.002v5.66\" class=\"hi\"/\u003e\u003c/g\u003e\u003c/g\u003e\u003c/svg\u003e","Taste":"Sweet flavor with bitter aftertaste","Therapeutic Uses":"/EXP THER/  This study examined the effect of 1,3-butanediol on the selective loss of CA1 pyramidal neurons following a short period of near-complete forebrain ischemia. Injection of 55 mmol 1,3-butanediol/kg body weight at 24 h of recirculation and again at 36 hr following 10 min of forebrain ischemia markedly reduced damage to CA1 neurons examined at 72 hr of recirculation compared with that in saline-treated rats. Comparable treatment with ethanol did not cause significant protection. Neuronal loss was also not reduced by 1,3-butanediol treatment when the ischemic period was extended to 15 min or by single treatments at 24 hr or 36 hr following 10 min of ischemia. However, a single treatment 5 min after reversal of 10 min of ischemia was effective in ameliorating cell loss. The difference in effectiveness of 1,3-butanediol following 10 min and 15 min of ischemia is consistent with a number of previous studies, indicating that the processes leading to loss of CA1 neurons are modified when the ischemic period is extended. Previous findings that 1,3-butanediol reduced damage in other ischemia-susceptible neuronal subpopulations but not in CA1 neurons most likely reflected the longer period of ischemia which was used. The results of the present investigation demonstrate that administration of 1,3-butanediol offers a novel approach for interfering with post-ischemic loss of CA1 neurons following a brief ischemic period which is effective even when initiated after prolonged recirculation periods.","Title":"1,3-Butanediol","UNII":"3XUS85K0RA","Wikipedia":"1,3-Butanediol","XLogP":-0.4}