1.0 2010-04-08 22:09:21 UTC 2019-11-26 03:04:13 UTC FDB010872 2,6-Dimethoxy-4-phenanthrenol Found in opium extracts 2,6-Dimethoxy-4-phenanthrenol 3,7-Dimethoxy-5-hydroxyphenanthrene 4-Hydroxy-2,6-dimethoxyphenanthrene C16H14O3 254.2806 254.094294314 2,6-dimethoxyphenanthren-4-ol 2,6-dimethoxyphenanthren-4-ol 55806-42-3 COC1=CC2=C(C=C1)C=CC1=CC(OC)=CC(O)=C21 InChI=1S/C16H14O3/c1-18-12-6-5-10-3-4-11-7-13(19-2)9-15(17)16(11)14(10)8-12/h3-9,17H,1-2H3 NTVJURNVFOEVHP-UHFFFAOYSA-N belongs to the class of organic compounds known as phenanthrols. Phenanthrols are compounds containing a phenanthrene (or its hydrogenated derivative) to which a hydroxyl group is attached. Phenanthrols Organic compounds Benzenoids Phenanthrenes and derivatives Phenanthrols Aromatic homopolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Anisoles Hydrocarbon derivatives Naphthols and derivatives 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 1-naphthol Alkyl aryl ether Anisole Aromatic homopolycyclic compound Ether Hydrocarbon derivative Naphthalene Organic oxygen compound Organooxygen compound Phenanthrol logp 3.64 ALOGPS logs -4.40 ALOGPS solubility 1.02e-02 g/l ALOGPS logp 3.33 ChemAxon pka_strongest_acidic 8.9 ChemAxon pka_strongest_basic -4.5 ChemAxon iupac 2,6-dimethoxyphenanthren-4-ol ChemAxon average_mass 254.2806 ChemAxon mono_mass 254.094294314 ChemAxon smiles COC1=CC2=C(C=C1)C=CC1=CC(OC)=CC(O)=C21 ChemAxon formula C16H14O3 ChemAxon inchi InChI=1S/C16H14O3/c1-18-12-6-5-10-3-4-11-7-13(19-2)9-15(17)16(11)14(10)8-12/h3-9,17H,1-2H3 ChemAxon inchikey NTVJURNVFOEVHP-UHFFFAOYSA-N ChemAxon polar_surface_area 38.69 ChemAxon refractivity 73.87 ChemAxon polarizability 27.55 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 22815 Specdb::CMs 43014 Specdb::CMs 149009 Specdb::MsMs 107223 Specdb::MsMs 107224 Specdb::MsMs 107225 Specdb::MsMs 174144 Specdb::MsMs 174145 Specdb::MsMs 174146 Specdb::MsMs 2749543 Specdb::MsMs 2749544 Specdb::MsMs 2749545 Specdb::MsMs 2928547 Specdb::MsMs 2928548 Specdb::MsMs 2928549 HMDB32890 #<Reference:0x000055ce31ec0298> Opium poppy Type 1 specific Papaver somniferum 3469