HIT ID: HIT214316820
Cas No: 1836-22-2
分子式: C17H12N2Na3O9S2
分子量: 521.38
常用名: C.I. Pigment Red 60
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-[2-(2-hydroxy-3,6-disulfonaphthalen-1-yl)diazen-1-yl]benzoic acid trisodium
IUPAC: 2-[2-(2-hydroxy-3,6-disulfonaphthalen-1-yl)diazen-1-yl]benzoic acid trisodium
SMILES: [Na].[Na].[Na].OC(=O)c1ccccc1N=Nc1c(O)c(cc2cc(ccc12)S(O)(=O)=O)S(O)(=O)=O |w:12.9|jcExt:v:0:0,1:0,2:0
SMILES: [Na].[Na].[Na].OC(=O)c1ccccc1N=Nc1c(O)c(cc2cc(ccc12)S(O)(=O)=O)S(O)(=O)=O |w:12.9|jcExt:v:0:0,1:0,2:0
InChI key: WFAIPVSMRHJCGU-UHFFFAOYSA-N
