764655-86-9
4-BROMO-2-(2-(4-PROPOXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
Name4-BROMO-2-(2-(4-PROPOXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
FormulaC24 H20 Br Cl N2 O4
1Identification
【Name】
4-BROMO-2-(2-(4-PROPOXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
【CAS】
【MDL】
MFCD05154615
【English Synonyms】
【Formula】
C24 H20 Br Cl N2 O4
【MolWeight】
515.789
【Inchi】
InChI=1S/C24H20BrClN2O4/c1-2-13-31-19-10-7-16(8-11-19)23(29)28-27-15-17-14-18(25)9-12-22(17)32-24(30)20-5-3-4-6-21(20)26/h3-12,14-15H,2,13H2,1H3,(H,28,29)/b27-15+
【InChIKey】
InChIKey=JKAXGXBTLIRBAI-JFLMPSFJSA-N
【SMILES】
CCCOc1ccc(cc1)C(=O)N/N=C/c2cc(ccc2OC(=O)c3ccccc3Cl)Br
【MOL File】
4-BROMO-2-(2-(4-PROP….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
4-BROMO-2-(2-(4-PROPOXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE.cml