765277-05-2
4-(2-(2-BROMOBENZOYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 4-ETHOXYBENZOATE
Name4-(2-(2-BROMOBENZOYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 4-ETHOXYBENZOATE
1Identification
【Name】
4-(2-(2-BROMOBENZOYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 4-ETHOXYBENZOATE
【CAS】
【MDL】
MFCD06200132
【English Synonyms】
【Formula】
C24 H21 Br N2 O5
【MolWeight】
497.343
【Inchi】
InChI=1S/C24H21BrN2O5/c1-3-31-18-11-9-17(10-12-18)24(29)32-21-13-8-16(14-22(21)30-2)15-26-27-23(28)19-6-4-5-7-20(19)25/h4-15H,3H2,1-2H3,(H,27,28)/b26-15+
【InChIKey】
InChIKey=AFQOHVCWGCTSNH-CVKSISIWSA-N
【SMILES】
CCOc1ccc(cc1)C(=O)Oc2ccc(cc2OC)/C=N/NC(=O)c3ccccc3Br
【MOL File】
4-(2-(2-BROMOBENZOYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-(2-BROMOBENZOYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 4-ETHOXYBENZOATE.cml