1.0 2010-04-08 22:06:19 UTC 2025-11-18 22:56:56 UTC FDB004621 3-Methylpentan-3-ol 3-methylpentan-3-ol is a member of the class of compounds known as tertiary alcohols. Tertiary alcohols are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ). Thus, 3-methylpentan-3-ol is considered to be a fatty alcohol lipid molecule. 3-methylpentan-3-ol is soluble (in water) and an extremely weak acidic compound (based on its pKa). 3-methylpentan-3-ol is a fruity, green, and leafy tasting compound and can be found in a number of food items such as green bell pepper, pepper (c. annuum), orange bell pepper, and red bell pepper, which makes 3-methylpentan-3-ol a potential biomarker for the consumption of these food products. 3-Methyl-3-pentanol 3-Methylpentan-3-ol Diethyl methyl carbinol Diethylmethylcarbinol Methyldiaethylcarbinol Methyldiethylcarbinol C6H14O 102.1748 102.10446507 3-methylpentan-3-ol 3-methyl-3-pentanol 77-74-7 CCC(C)(O)CC InChI=1S/C6H14O/c1-4-6(3,7)5-2/h7H,4-5H2,1-3H3 FRDAATYAJDYRNW-UHFFFAOYSA-N belongs to the class of organic compounds known as tertiary alcohols. Tertiary alcohols are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ). Tertiary alcohols Organic compounds Organic oxygen compounds Organooxygen compounds Alcohols and polyols Aliphatic acyclic compounds Hydrocarbon derivatives Aliphatic acyclic compound Hydrocarbon derivative Tertiary alcohol Fatty alcohols liquid logp 1.54 ALOGPS logs -0.59 ALOGPS solubility 2.64e+01 g/l ALOGPS melting_point -23.6 oC logp 1.58 ChemAxon pka_strongest_acidic 19.03 ChemAxon pka_strongest_basic -1 ChemAxon iupac 3-methylpentan-3-ol ChemAxon average_mass 102.1748 ChemAxon mono_mass 102.10446507 ChemAxon smiles CCC(C)(O)CC ChemAxon formula C6H14O ChemAxon inchi InChI=1S/C6H14O/c1-4-6(3,7)5-2/h7H,4-5H2,1-3H3 ChemAxon inchikey FRDAATYAJDYRNW-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 31.11 ChemAxon polarizability 12.71 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::NmrOneD 3976 Specdb::NmrOneD 4261 Specdb::EiMs 1863 Specdb::MsMs 63342 Specdb::MsMs 63343 Specdb::MsMs 63344 Specdb::MsMs 120291 Specdb::MsMs 120292 Specdb::MsMs 120293 Specdb::MsMs 3600713 Specdb::MsMs 3600714 Specdb::MsMs 3600715 Specdb::MsMs 3600716 Specdb::MsMs 3600717 Specdb::MsMs 3600718 Green bell pepper Type 1 specific Capsicum annuum 4072 Orange bell pepper Type 1 specific Capsicum annuum 4072 Pepper Type 1 specific Capsicum annuum 4072 Red bell pepper Type 1 specific Capsicum annuum 4072 Yellow bell pepper Type 1 specific Capsicum annuum 4072 fruity green leafy powerful