35510-94-2
4-HYDROXY-N-(4-HYDROXYPHENYL)-2-METHYL-, 1,1-DIOXIDE
Name4-HYDROXY-N-(4-HYDROXYPHENYL)-2-METHYL-, 1,1-DIOXIDE
pro_formulaC16 H14 N2 O5 S
1Identification
【Name】
4-HYDROXY-N-(4-HYDROXYPHENYL)-2-METHYL-, 1,1-DIOXIDE
【CAS】
【MDL】
MFCD17019465
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C16 H14 N2 O5 S
【pro_molWeight】
346.362
【Inchi】
InChI=1S/C16H14N2O5S/c1-18-14(16(21)17-10-6-8-11(19)9-7-10)15(20)12-4-2-3-5-13(12)24(18,22)23/h2-9,19-20H,1H3,(H,17,21)
【InChIKey】
InChIKey=KOEIOKYGXOBYFC-UHFFFAOYSA-N
【SMILES】
CN1C(=C(c2ccccc2S1(=O)=O)O)C(=O)Nc3ccc(cc3)O
【MOL File】
4-HYDROXY-N-(4-HYDRO….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:3
pro_acceptors:7
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4-HYDROXY-N-(4-HYDROXYPHENYL)-2-METHYL-, 1,1-DIOXIDE.cml