1.0 2010-04-08 22:06:01 UTC 2025-11-18 22:54:26 UTC FDB003947 Hex-trans-3-en-1-ol Trans-3-hexen-1-ol, also known as 3-hexen-1-ol, (E)-isomer or cis-3-hexenol, is a member of the class of compounds known as fatty alcohols. Fatty alcohols are aliphatic alcohols consisting of a chain of a least six carbon atoms. Thus, trans-3-hexen-1-ol is considered to be a fatty alcohol lipid molecule. Trans-3-hexen-1-ol is soluble (in water) and an extremely weak acidic compound (based on its pKa). Trans-3-hexen-1-ol can be found in corn, spearmint, watermelon, and wild celery, which makes trans-3-hexen-1-ol a potential biomarker for the consumption of these food products. Trans-3-hexen-1-ol may be a unique S.cerevisiae (yeast) metabolite. C6H12O 100.1589 100.088815006 (3E)-hex-3-en-1-ol 3-hexene-1-ol CC\C=C\CCO InChI=1S/C6H12O/c1-2-3-4-5-6-7/h3-4,7H,2,5-6H2,1H3/b4-3+ UFLHIIWVXFIJGU-ONEGZZNKSA-N belongs to the class of organic compounds known as fatty alcohols. These are aliphatic alcohols consisting of a chain of a least six carbon atoms. Fatty alcohols Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty alcohols Aliphatic acyclic compounds Hydrocarbon derivatives Primary alcohols Alcohol Aliphatic acyclic compound Fatty alcohol Hydrocarbon derivative Organic oxygen compound Organooxygen compound Primary alcohol Fatty alcohols logp 1.33 ChemAxon pka_strongest_acidic 16.79 ChemAxon pka_strongest_basic -2 ChemAxon iupac (3E)-hex-3-en-1-ol ChemAxon average_mass 100.1589 ChemAxon mono_mass 100.088815006 ChemAxon smiles CC\C=C\CCO ChemAxon formula C6H12O ChemAxon inchi InChI=1S/C6H12O/c1-2-3-4-5-6-7/h3-4,7H,2,5-6H2,1H3/b4-3+ ChemAxon inchikey UFLHIIWVXFIJGU-ONEGZZNKSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 32.45 ChemAxon polarizability 12.46 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 3196 Specdb::NmrOneD 4529 Specdb::NmrOneD 4658 Specdb::NmrOneD 285029 Specdb::NmrOneD 285030 Specdb::NmrOneD 285031 Specdb::NmrOneD 285032 Specdb::NmrOneD 285033 Specdb::NmrOneD 285034 Specdb::NmrOneD 285035 Specdb::NmrOneD 285036 Specdb::NmrOneD 285037 Specdb::NmrOneD 285038 Specdb::NmrOneD 285039 Specdb::NmrOneD 285040 Specdb::NmrOneD 285041 Specdb::NmrOneD 285042 Specdb::NmrOneD 285043 Specdb::NmrOneD 285044 Specdb::NmrOneD 285045 Specdb::NmrOneD 285046 Specdb::NmrOneD 285047 Specdb::NmrOneD 285048 Specdb::MsMs 99699 Specdb::MsMs 99700 Specdb::MsMs 99701 Specdb::MsMs 164874 Specdb::MsMs 164875 Specdb::MsMs 164876 Specdb::MsMs 3599657 Specdb::MsMs 3599658 Specdb::MsMs 3599659 Specdb::MsMs 3599660 Specdb::MsMs 3599661 Specdb::MsMs 3599662 Corn Type 1 specific Zea mays 4577 Spearmint Type 1 specific Mentha spicata 29719 Watermelon Type 1 specific Citrullus lanatus 3654 Wild celery Type 1 specific Apium graveolens 4045