885269-85-2
3-[4-(4-METHYLPHENYL)PHENYLSULFONAMIDO]BENZOIC ACID
Name3-[4-(4-METHYLPHENYL)PHENYLSULFONAMIDO]BENZOIC ACID
1Identification
【Name】
3-[4-(4-METHYLPHENYL)PHENYLSULFONAMIDO]BENZOIC ACID
【CAS】
【MDL】
MFCD06409492
【English Synonyms】
【Formula】
C20 H17 N O4 S
【MolWeight】
367.423
【Inchi】
InChI=1S/C20H17NO4S/c1-14-5-7-15(8-6-14)16-9-11-19(12-10-16)26(24,25)21-18-4-2-3-17(13-18)20(22)23/h2-13,21H,1H3,(H,22,23)
【InChIKey】
InChIKey=XCBCVFOAJDITJV-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)c2ccc(cc2)S(=O)(=O)Nc3cccc(c3)C(=O)O
【MOL File】
3-[4-(4-METHYLPHENYL….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
3-[4-(4-METHYLPHENYL)PHENYLSULFONAMIDO]BENZOIC ACID.cml