854035-86-2
[5-[(DIETHYLAMINO)SULFONYL]-2-OXOPYRIDIN-1(2H)-YL]ACETIC ACID
Name[5-[(DIETHYLAMINO)SULFONYL]-2-OXOPYRIDIN-1(2H)-YL]ACETIC ACID
pro_formulaC11 H16 N2 O5 S
1Identification
【Name】
[5-[(DIETHYLAMINO)SULFONYL]-2-OXOPYRIDIN-1(2H)-YL]ACETIC ACID
【CAS】
【MDL】
MFCD06655178
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C11 H16 N2 O5 S
【pro_molWeight】
288.322
【Inchi】
InChI=1S/C11H16N2O5S/c1-3-13(4-2)19(17,18)9-5-6-10(14)12(7-9)8-11(15)16/h5-7H,3-4,8H2,1-2H3,(H,15,16)
【InChIKey】
InChIKey=PAGBNETUTYKLIL-UHFFFAOYSA-N
【SMILES】
CCN(CC)S(=O)(=O)c1ccc(=O)n(c1)CC(=O)O
【MOL File】
[5-[(DIETHYLAMINO)SU….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:7
XLogP3:0.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
[5-[(DIETHYLAMINO)SULFONYL]-2-OXOPYRIDIN-1(2H)-YL]ACETIC ACID.cml