767332-77-4
4-(2-(((1-BR-2-NAPHTHYL)OXY)AC)CARBOHYDRAZONOYL)2-ETHOXYPHENYL 4-METHOXYBENZOATE
Name4-(2-(((1-BR-2-NAPHTHYL)OXY)AC)CARBOHYDRAZONOYL)2-ETHOXYPHENYL 4-METHOXYBENZOATE
1Identification
【Name】
4-(2-(((1-BR-2-NAPHTHYL)OXY)AC)CARBOHYDRAZONOYL)2-ETHOXYPHENYL 4-METHOXYBENZOATE
【CAS】
【MDL】
MFCD06199633
【English Synonyms】
【Formula】
C29 H25 Br N2 O6
【MolWeight】
577.429
【Inchi】
InChI=1S/C29H25BrN2O6/c1-3-36-26-16-19(8-14-24(26)38-29(34)21-9-12-22(35-2)13-10-21)17-31-32-27(33)18-37-25-15-11-20-6-4-5-7-23(20)28(25)30/h4-17H,3,18H2,1-2H3,(H,32,33)/b31-17+
【InChIKey】
InChIKey=BJWXJLFSTVEKEY-KBVAKVRCSA-N
【SMILES】
CCOc1cc(ccc1OC(=O)c2ccc(cc2)OC)/C=N/NC(=O)COc3ccc4ccccc4c3Br
【MOL File】
4-(2-(((1-BR-2-NAPHT….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-(((1-BR-2-NAPHTHYL)OXY)AC)CARBOHYDRAZONOYL)2-ETHOXYPHENYL 4-METHOXYBENZOATE.cml