5855-83-4
3-(5-HYDROXY-7-SULFONAPHTHALEN-2-YLAMINO)BENZOIC ACID
Name3-(5-HYDROXY-7-SULFONAPHTHALEN-2-YLAMINO)BENZOIC ACID
1Identification
【Name】
3-(5-HYDROXY-7-SULFONAPHTHALEN-2-YLAMINO)BENZOIC ACID
【CAS】
【MDL】
MFCD18974625
【English Synonyms】
【Formula】
C17 H13 N O6 S
【MolWeight】
359.357
【Inchi】
InChI=1S/C17H13NO6S/c19-16-9-14(25(22,23)24)8-11-7-13(4-5-15(11)16)18-12-3-1-2-10(6-12)17(20)21/h1-9,18-19H,(H,20,21)(H,22,23,24)
【InChIKey】
InChIKey=XZZXSKLLOHOYFK-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)Nc2ccc3c(c2)cc(cc3O)S(=O)(=O)O)C(=O)O
【MOL File】
3-(5-HYDROXY-7-SULFO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(5-HYDROXY-7-SULFONAPHTHALEN-2-YLAMINO)BENZOIC ACID.cml