854035-86-2
[5-[(DIETHYLAMINO)SULFONYL]-2-OXOPYRIDIN-1(2H)-YL]ACETIC ACID
Name[5-[(DIETHYLAMINO)SULFONYL]-2-OXOPYRIDIN-1(2H)-YL]ACETIC ACID
1Identification
【Name】
[5-[(DIETHYLAMINO)SULFONYL]-2-OXOPYRIDIN-1(2H)-YL]ACETIC ACID
【CAS】
【MDL】
MFCD06655178
【English Synonyms】
【Formula】
C11 H16 N2 O5 S
【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
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
[5-[(DIETHYLAMINO)SULFONYL]-2-OXOPYRIDIN-1(2H)-YL]ACETIC ACID.cml