764655-49-4
1-(2-(2,4-DIHYDROXYBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-ETHOXYBENZOATE
Name1-(2-(2,4-DIHYDROXYBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-ETHOXYBENZOATE
1Identification
【Name】
1-(2-(2,4-DIHYDROXYBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-ETHOXYBENZOATE
【CAS】
【MDL】
MFCD05154654
【English Synonyms】
【Formula】
C27 H22 N2 O6
【MolWeight】
470.479
【Inchi】
InChI=1S/C27H22N2O6/c1-2-34-20-11-7-18(8-12-20)27(33)35-25-14-9-17-5-3-4-6-21(17)23(25)16-28-29-26(32)22-13-10-19(30)15-24(22)31/h3-16,30-31H,2H2,1H3,(H,29,32)/b28-16+
【InChIKey】
InChIKey=OSKOHUYRFZUGTK-LQKURTRISA-N
【SMILES】
CCOc1ccc(cc1)C(=O)Oc2ccc3ccccc3c2/C=N/NC(=O)c4ccc(cc4O)O
【MOL File】
1-(2-(2,4-DIHYDROXYB….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:8
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-(2,4-DIHYDROXYBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-ETHOXYBENZOATE.cml