1.0 2010-04-08 22:09:58 UTC 2025-11-18 23:33:25 UTC FDB012053 beta-O-Methylynephrine obtained from tangerine leaves, poss. as artifact. beta-O-Methylynephrine is found in citrus. b-O-Methylsynephrine C10H15NO2 181.2316 181.110278729 4-[1-methoxy-2-(methylamino)ethyl]phenol 4-[1-methoxy-2-(methylamino)ethyl]phenol 60094-92-0 CNCC(OC)C1=CC=C(O)C=C1 InChI=1S/C10H15NO2/c1-11-7-10(13-2)8-3-5-9(12)6-4-8/h3-6,10-12H,7H2,1-2H3 LVZUJPSBCGHXGZ-UHFFFAOYSA-N belongs to the class of organic compounds known as benzylethers. These are aromatic ethers with the general formula ROCR' (R = alkyl, aryl; R'=benzene). Benzylethers Organic compounds Benzenoids Benzene and substituted derivatives Benzylethers Aromatic homomonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Dialkyl ethers Dialkylamines Hydrocarbon derivatives Organopnictogen compounds 1-hydroxy-2-unsubstituted benzenoid Amine Aralkylamine Aromatic homomonocyclic compound Benzylether Dialkyl ether Ether Hydrocarbon derivative Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenol Secondary aliphatic amine Secondary amine logp 0.76 ALOGPS logs -1.61 ALOGPS solubility 4.47e+00 g/l ALOGPS melting_point Mp 182-184° (175-176°) (as hydrochloride) logp 0.63 ChemAxon pka_strongest_acidic 9.72 ChemAxon pka_strongest_basic 9.1 ChemAxon iupac 4-[1-methoxy-2-(methylamino)ethyl]phenol ChemAxon average_mass 181.2316 ChemAxon mono_mass 181.110278729 ChemAxon smiles CNCC(OC)C1=CC=C(O)C=C1 ChemAxon formula C10H15NO2 ChemAxon inchi InChI=1S/C10H15NO2/c1-11-7-10(13-2)8-3-5-9(12)6-4-8/h3-6,10-12H,7H2,1-2H3 ChemAxon inchikey LVZUJPSBCGHXGZ-UHFFFAOYSA-N ChemAxon polar_surface_area 41.49 ChemAxon refractivity 52 ChemAxon polarizability 20.03 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 14766 Specdb::CMs 43550 Specdb::CMs 171901 Specdb::NmrOneD 123358 Specdb::NmrOneD 123359 Specdb::NmrOneD 123360 Specdb::NmrOneD 123361 Specdb::NmrOneD 123362 Specdb::NmrOneD 123363 Specdb::NmrOneD 123364 Specdb::NmrOneD 123365 Specdb::NmrOneD 123366 Specdb::NmrOneD 123367 Specdb::NmrOneD 123368 Specdb::NmrOneD 123369 Specdb::NmrOneD 123370 Specdb::NmrOneD 123371 Specdb::NmrOneD 123372 Specdb::NmrOneD 123373 Specdb::NmrOneD 123374 Specdb::NmrOneD 123375 Specdb::NmrOneD 123376 Specdb::NmrOneD 123377 Specdb::MsIr 6319 Specdb::MsIr 6320 Specdb::MsIr 6321 Specdb::MsMs 77733 Specdb::MsMs 77734 Specdb::MsMs 77735 Specdb::MsMs 137925 Specdb::MsMs 137926 Specdb::MsMs 137927 Specdb::MsMs 2445928 Specdb::MsMs 2445929 Specdb::MsMs 2445930 Specdb::MsMs 2515962 Specdb::MsMs 2515963 Specdb::MsMs 2515964 HMDB33868 #<Reference:0x000055ce31a40bc8> Citrus Unknown generic