769153-38-0
1-(2-(3,4-DICHLOROBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE
Name1-(2-(3,4-DICHLOROBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE
1Identification
【Name】
1-(2-(3,4-DICHLOROBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE
【CAS】
【MDL】
MFCD05153432
【English Synonyms】
【Formula】
C26 H18 Cl2 N2 O4
【MolWeight】
493.344
【Inchi】
InChI=1S/C26H18Cl2N2O4/c1-33-19-10-6-17(7-11-19)26(32)34-24-13-9-16-4-2-3-5-20(16)21(24)15-29-30-25(31)18-8-12-22(27)23(28)14-18/h2-15H,1H3,(H,30,31)/b29-15+
【InChIKey】
InChIKey=VVNNATZJHFYSGQ-WKULSOCRSA-N
【SMILES】
COc1ccc(cc1)C(=O)Oc2ccc3ccccc3c2/C=N/NC(=O)c4ccc(c(c4)Cl)Cl
【MOL File】
1-(2-(3,4-DICHLOROBE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-(3,4-DICHLOROBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE.cml