1.0 2010-04-08 22:14:44 UTC 2015-07-21 06:41:38 UTC FDB020010 2-(Ethylsulfinylmethyl)phenyl methylcarbamate Ethiofencarb metabolite 2-((Ethylsulfinyl)methyl)phenol methylcarbamate 2-(Ethylsulfinylmethyl)phenyl methylcarbamate Croneton sulfoxide Ethiofencarb sulfoxide Ethiofencarb-sulfoxide Phenol, 2-((ethylsulfinyl)methyl)-, methylcarbamate C11H15NO3S 241.307 241.077264041 2-[(ethanesulfinyl)methyl]phenyl N-methylcarbamate 2-[(ethanesulfinyl)methyl]phenyl N-methylcarbamate 53380-22-6 CCS(=O)CC1=C(OC(=O)NC)C=CC=C1 InChI=1S/C11H15NO3S/c1-3-16(14)8-9-6-4-5-7-10(9)15-11(13)12-2/h4-7H,3,8H2,1-2H3,(H,12,13) OMOLDRXZKFFGJI-UHFFFAOYSA-N belongs to the class of organic compounds known as phenyl methylcarbamates. These are aromatic compounds containing a methylcarbamic acid esterified with a phenyl group. Phenyl methylcarbamates Organic compounds Benzenoids Benzene and substituted derivatives Phenyl methylcarbamates Aromatic homomonocyclic compounds Benzyl alkyl sulfoxides Carbamate esters Carbonyl compounds Hydrocarbon derivatives Organic carbonic acids and derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds Phenoxy compounds Sulfinyl compounds Sulfoxides Aromatic homomonocyclic compound Benzyl alkyl sulfoxide Benzyl sulfoxide Carbamic acid ester Carbonic acid derivative Carbonyl group Hydrocarbon derivative Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Organosulfur compound Phenoxy compound Phenyl methylcarbamate Sulfinyl compound Sulfoxide logp 1.04 ALOGPS logs -1.88 ALOGPS solubility 3.15e+00 g/l ALOGPS logp 0.48 ChemAxon pka_strongest_acidic 14.77 ChemAxon pka_strongest_basic -6.5 ChemAxon iupac 2-[(ethanesulfinyl)methyl]phenyl N-methylcarbamate ChemAxon average_mass 241.307 ChemAxon mono_mass 241.077264041 ChemAxon smiles CCS(=O)CC1=C(OC(=O)NC)C=CC=C1 ChemAxon formula C11H15NO3S ChemAxon inchi InChI=1S/C11H15NO3S/c1-3-16(14)8-9-6-4-5-7-10(9)15-11(13)12-2/h4-7H,3,8H2,1-2H3,(H,12,13) ChemAxon inchikey OMOLDRXZKFFGJI-UHFFFAOYSA-N ChemAxon polar_surface_area 55.4 ChemAxon refractivity 64.74 ChemAxon polarizability 24.83 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 16536 Specdb::CMs 165623 Specdb::MsMs 302542 Specdb::MsMs 302543 Specdb::MsMs 302544 Specdb::MsMs 345292 Specdb::MsMs 345293 Specdb::MsMs 345294 Specdb::MsMs 2401982 Specdb::MsMs 2401983 Specdb::MsMs 2401984 Specdb::MsMs 2533812 Specdb::MsMs 2533813 Specdb::MsMs 2533814 Specdb::NmrOneD 39622 Specdb::NmrOneD 39623 Specdb::NmrOneD 39624 Specdb::NmrOneD 39625 Specdb::NmrOneD 39626 Specdb::NmrOneD 39627 Specdb::NmrOneD 39628 Specdb::NmrOneD 39629 Specdb::NmrOneD 39630 Specdb::NmrOneD 39631 Specdb::NmrOneD 39632 Specdb::NmrOneD 39633 Specdb::NmrOneD 39634 Specdb::NmrOneD 39635 Specdb::NmrOneD 39636 Specdb::NmrOneD 39637 Specdb::NmrOneD 39638 Specdb::NmrOneD 39639 Specdb::NmrOneD 39640 Specdb::NmrOneD 39641 HMDB40289 #<Reference:0x000055ce325e8840> #<Reference:0x000055ce325e8688>