93568-54-8
[4-(DIETHYLSULFAMOYL)-2-METHYLPHENOXY]ACETIC ACID
Name[4-(DIETHYLSULFAMOYL)-2-METHYLPHENOXY]ACETIC ACID
pro_formulaC13 H19 N O5 S
1Identification
【Name】
[4-(DIETHYLSULFAMOYL)-2-METHYLPHENOXY]ACETIC ACID
【CAS】
【MDL】
MFCD09754864
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C13 H19 N O5 S
【pro_molWeight】
301.361
【Inchi】
InChI=1S/C13H19NO5S/c1-4-14(5-2)20(17,18)11-6-7-12(10(3)8-11)19-9-13(15)16/h6-8H,4-5,9H2,1-3H3,(H,15,16)
【InChIKey】
InChIKey=ILFNCMJDJIUFKP-UHFFFAOYSA-N
【SMILES】
CCN(CC)S(=O)(=O)c1ccc(c(c1)C)OCC(=O)O
【MOL File】
[4-(DIETHYLSULFAMOYL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:6
XLogP3:1.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
[4-(DIETHYLSULFAMOYL)-2-METHYLPHENOXY]ACETIC ACID.cml