885269-38-5
1-(4'-CHLORO-4-BIPHENYLYLSULFONYLAMINO)CYCLOHEXANECARBOXYLIC ACID
Name1-(4'-CHLORO-4-BIPHENYLYLSULFONYLAMINO)CYCLOHEXANECARBOXYLIC ACID
1Identification
【Name】
1-(4'-CHLORO-4-BIPHENYLYLSULFONYLAMINO)CYCLOHEXANECARBOXYLIC ACID
【CAS】
【MDL】
MFCD06409452
【English Synonyms】
【Formula】
C19 H20 Cl N O4 S
【MolWeight】
393.889
【Inchi】
InChI=1S/C19H20ClNO4S/c20-16-8-4-14(5-9-16)15-6-10-17(11-7-15)26(24,25)21-19(18(22)23)12-2-1-3-13-19/h4-11,21H,1-3,12-13H2,(H,22,23)
【InChIKey】
InChIKey=KBGSRCCFSIWOBR-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1c2ccc(cc2)Cl)S(=O)(=O)NC3(CCCCC3)C(=O)O
【MOL File】
1-(4'-CHLORO-4-BIPHE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(4'-CHLORO-4-BIPHENYLYLSULFONYLAMINO)CYCLOHEXANECARBOXYLIC ACID.cml