1.0 2010-04-08 22:10:14 UTC 2019-11-26 03:07:02 UTC FDB012550 1-Propanethiol Isolated from onion (Allium cepa) and other Allium sspecies Also present in cooked chicken, beef, beer, American potato chips and durian (Durio zibethinus). 1-Propanethiol is found in many foods, some of which are fruits, wild leek, yellow wax bean, and animal foods. 1-Mercaptopropane 1-Propanethoil 1-Propyl mercaptan 1-propylmercaptan 1-Propylthiol FEMA 3521 Mercaptan C3 n-C3H7SH N-propyl mercaptan N-propylmercaptan N-propylthiol N-thiopropyl alcohol Propane-1-thiol Propanethiol Propanethiol, sodium salt Propanethiols Propanethiols [UN2402] [Flammable liquid] Propyl mercaptan Propylthiol SSP Thiopropyl alcohol C3H8S 76.161 76.034670946 propane-1-thiol propanethiol 107-03-9 CCCS InChI=1S/C3H8S/c1-2-3-4/h4H,2-3H2,1H3 SUVIGLJNEAMWEG-UHFFFAOYSA-N belongs to the class of organic compounds known as alkylthiols. These are organic compounds containing the thiol functional group linked to an alkyl chain. Alkylthiols Organic compounds Organosulfur compounds Thiols Alkylthiols Aliphatic acyclic compounds Hydrocarbon derivatives Aliphatic acyclic compound Alkylthiol Hydrocarbon derivative alkanethiol logp 1.72 ALOGPS logs -1.18 ALOGPS solubility 4.99e+00 g/l ALOGPS melting_point Mp -113.3° logp 1.61 ChemAxon pka_strongest_acidic 10.2 ChemAxon iupac propane-1-thiol ChemAxon average_mass 76.161 ChemAxon mono_mass 76.034670946 ChemAxon smiles CCCS ChemAxon formula C3H8S ChemAxon inchi InChI=1S/C3H8S/c1-2-3-4/h4H,2-3H2,1H3 ChemAxon inchikey SUVIGLJNEAMWEG-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 23.56 ChemAxon polarizability 9.26 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 0 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 5969 Specdb::CMs 29436 Specdb::CMs 101579 Specdb::CMs 137781 Specdb::CMs 145515 Specdb::EiMs 1601 Specdb::NmrOneD 3777 Specdb::NmrOneD 4036 Specdb::NmrOneD 125138 Specdb::NmrOneD 125139 Specdb::NmrOneD 125140 Specdb::NmrOneD 125141 Specdb::NmrOneD 125142 Specdb::NmrOneD 125143 Specdb::NmrOneD 125144 Specdb::NmrOneD 125145 Specdb::NmrOneD 125146 Specdb::NmrOneD 125147 Specdb::NmrOneD 125148 Specdb::NmrOneD 125149 Specdb::NmrOneD 125150 Specdb::NmrOneD 125151 Specdb::NmrOneD 125152 Specdb::NmrOneD 125153 Specdb::NmrOneD 125154 Specdb::NmrOneD 125155 Specdb::NmrOneD 125156 Specdb::NmrOneD 125157 Specdb::MsMs 56481 Specdb::MsMs 56482 Specdb::MsMs 56483 Specdb::MsMs 111915 Specdb::MsMs 111916 Specdb::MsMs 111917 Specdb::MsMs 2451349 Specdb::MsMs 2451350 Specdb::MsMs 2451351 Specdb::MsMs 2487699 Specdb::MsMs 2487700 Specdb::MsMs 2487701 Specdb::MsIr 6507 Specdb::MsIr 6508 Specdb::MsIr 6509 HMDB34238 8473 XL3 #<Reference:0x000055ce3332b480> Alcoholic beverages Unknown generic Allium Type 1 specific Allium 4678 Cabbage Type 1 specific Brassica oleracea var. capitata 3716 Common bean Type 1 specific Phaseolus vulgaris 3885 Common pea Type 1 specific Pisum sativum 3888 Fruits Unknown generic Garden onion Type 1 specific Allium cepa 4679 Garden onion (var.) Type 1 specific Allium cepa var. cepa 4679 Green bean Type 1 specific Phaseolus vulgaris 3885 Green onion Type 1 Leek Type 1 specific Allium porrum Onion-family vegetables Unknown generic Potato Type 1 specific Solanum tuberosum 4113 Red onion Type 1 Welsh onion Type 1 specific Allium fistulosum 35875 Wild leek Type 1 specific Allium ampeloprasum 4681 Yellow wax bean Type 1 specific Phaseolus vulgaris 3885 cabbage gassy natural onion sweet Name 936 A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell.