1.0 2010-04-08 22:08:22 UTC 2025-11-18 23:14:51 UTC FDB009012 Beeswax It is used as a food additive . C8H11NO3 169.1778 169.073893223 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol pyridoxine 8012-89-3 CC1=C(O)C(CO)=C(CO)C=N1 InChI=1S/C8H11NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2,10-12H,3-4H2,1H3 LXNHXLLTXMVWPM-UHFFFAOYSA-N belongs to the class of organic compounds known as pyridoxines. These are pyridoxal derivatives in which the carbaldehyde group at position 2 of the pyridoxal moiety is replaced by a hydroxymethyl group. Pyridoxines Organic compounds Organoheterocyclic compounds Pyridines and derivatives Pyridoxines Aromatic heteromonocyclic compounds Aromatic alcohols Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Hydroxypyridines Methylpyridines Organonitrogen compounds Organopnictogen compounds Primary alcohols Alcohol Aromatic alcohol Aromatic heteromonocyclic compound Azacycle Heteroaromatic compound Hydrocarbon derivative Hydroxypyridine Methylpyridine Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary alcohol Pyridoxine Water-soluble vitamins a vitamin B6 hydroxymethylpyridine methylpyridines monohydroxypyridine vitamin B6 logp -0.57 ALOGPS logs -1.02 ALOGPS solubility 1.61e+01 g/l ALOGPS logp -0.95 ChemAxon pka_strongest_acidic 9.4 ChemAxon pka_strongest_basic 5.58 ChemAxon iupac 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol ChemAxon average_mass 169.1778 ChemAxon mono_mass 169.073893223 ChemAxon smiles CC1=C(O)C(CO)=C(CO)C=N1 ChemAxon formula C8H11NO3 ChemAxon inchi InChI=1S/C8H11NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2,10-12H,3-4H2,1H3 ChemAxon inchikey LXNHXLLTXMVWPM-UHFFFAOYSA-N ChemAxon polar_surface_area 73.58 ChemAxon refractivity 44.11 ChemAxon polarizability 17.11 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 4 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 483 Specdb::CMs 484 Specdb::CMs 485 Specdb::CMs 1609 Specdb::CMs 2727 Specdb::CMs 28249 Specdb::CMs 30228 Specdb::CMs 30676 Specdb::CMs 30928 Specdb::CMs 31098 Specdb::CMs 31882 Specdb::CMs 37380 Specdb::CMs 132032 Specdb::CMs 139766 Specdb::CMs 1055153 Specdb::CMs 1055155 Specdb::CMs 1055156 Specdb::CMs 1055158 Specdb::CMs 1055160 Specdb::CMs 1055162 Specdb::CMs 1055164 Specdb::CMs 1055165 Specdb::CMs 1055167 Specdb::CMs 1055169 Specdb::CMs 1055171 Specdb::EiMs 1069 Specdb::MsIr 335 Specdb::MsIr 336 Specdb::MsIr 337 Specdb::NmrOneD 1262 Specdb::NmrOneD 4738 Specdb::NmrOneD 4739 Specdb::NmrOneD 6232 Specdb::NmrOneD 6233 Specdb::NmrOneD 6234 Specdb::NmrOneD 6235 Specdb::NmrOneD 6236 Specdb::NmrOneD 6237 Specdb::NmrOneD 6238 Specdb::NmrOneD 6239 Specdb::NmrOneD 6240 Specdb::NmrOneD 6241 Specdb::NmrOneD 6242 Specdb::NmrOneD 6243 Specdb::NmrOneD 6244 Specdb::NmrOneD 6245 Specdb::NmrOneD 6246 Specdb::NmrOneD 6247 Specdb::NmrOneD 6248 Specdb::NmrOneD 6249 Specdb::NmrOneD 6250 Specdb::NmrOneD 6251 Specdb::NmrTwoD 1006 Specdb::NmrTwoD 1231 Specdb::MsMs 403 Specdb::MsMs 404 Specdb::MsMs 405 Specdb::MsMs 3720 Specdb::MsMs 3721 Specdb::MsMs 3722 Specdb::MsMs 3723 Specdb::MsMs 3724 Specdb::MsMs 3725 Specdb::MsMs 3726 Specdb::MsMs 3727 Specdb::MsMs 3728 Specdb::MsMs 3729 Specdb::MsMs 3730 Specdb::MsMs 3734 Specdb::MsMs 3735 Specdb::MsMs 19946 Specdb::MsMs 19947 Specdb::MsMs 19948 Specdb::MsMs 21497 Specdb::MsMs 21498 Specdb::MsMs 21499 Specdb::MsMs 438295 Specdb::MsMs 438296 Specdb::MsMs 438297 HMDB0000239