1.0 2020-03-10 16:59:15 UTC 2020-04-22 18:55:19 UTC BMDB0095981 BMDB95981 Hypothiocyanite (Hydroxysulfanyl)formonitrile Cyanosulfoxylic acid Hypocyanous acid (Hydroxysulphanyl)formonitrile Cyanosulfoxylate Cyanosulphoxylate Cyanosulphoxylic acid N,6-didehydro-3,6-dihydro-3-Methyl-adenosine OSCN-hypothiocyanite ion Hypothiocyanite ion Hypothiocyanite CHNOS 75.09 74.977884349 (hydroxysulfanyl)formonitrile cyanosulfoxylic acid 63296-34-4 OSC#N InChI=1S/CHNOS/c2-1-4-3/h3H ZCZCOXLLICTZAH-UHFFFAOYSA-N belongs to the class of organic compounds known as thiocyanates. These are salts or esters of thiocyanic acid, with the general formula RSC#N (R=alkyl, aryl). Organic compounds Organosulfur compounds Thiocyanates Thiocyanates Hydrocarbon derivatives Organic oxygen compounds Organonitrogen compounds Organopnictogen compounds SO-thioperoxols Sulfenyl compounds Aliphatic acyclic compound Hydrocarbon derivative Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organopnictogen compound So-thioperoxol Sulfenyl compound Thiocyanate Aliphatic acyclic compounds logp -0.93 ALOGPS logs -0.19 ALOGPS logp 0.35 ChemAxon pka_strongest_acidic 11.97 ChemAxon pka_strongest_basic -4.1 ChemAxon iupac (hydroxysulfanyl)formonitrile ChemAxon average_mass 75.09 ChemAxon mono_mass 74.977884349 ChemAxon smiles OSC#N ChemAxon formula CHNOS ChemAxon inchi InChI=1S/CHNOS/c2-1-4-3/h3H ChemAxon inchikey ZCZCOXLLICTZAH-UHFFFAOYSA-N ChemAxon polar_surface_area 44.02 ChemAxon refractivity 17.01 ChemAxon polarizability 5.93 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 0 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::MsMs 317206 Specdb::MsMs 317207 Specdb::MsMs 317208 Specdb::MsMs 363631 Specdb::MsMs 363632 Specdb::MsMs 363633 Specdb::MsMs 2674000 Specdb::MsMs 2674001 Specdb::MsMs 2674002 Specdb::MsMs 3032045 Specdb::MsMs 3032046 Specdb::MsMs 3032047 Specdb::MsIr 2824 Specdb::MsIr 2825 Specdb::MsIr 2826 Specdb::CMs 23062 Specdb::CMs 136310 Specdb::CMs 144044 FDB029228 111270 124985 133907 Hypothiocyanite