769150-90-5
4-BROMO-2-(2-((1-NAPHTHYLOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
Name4-BROMO-2-(2-((1-NAPHTHYLOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
FormulaC26 H18 Br Cl N2 O4
1Identification
【Name】
4-BROMO-2-(2-((1-NAPHTHYLOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
【CAS】
【MDL】
MFCD00644220
【English Synonyms】
【Formula】
C26 H18 Br Cl N2 O4
【MolWeight】
537.795
【Inchi】
InChI=1S/C26H18BrClN2O4/c27-19-12-13-23(34-26(32)21-9-3-4-10-22(21)28)18(14-19)15-29-30-25(31)16-33-24-11-5-7-17-6-1-2-8-20(17)24/h1-15H,16H2,(H,30,31)/b29-15+
【InChIKey】
InChIKey=USSHWNMSVIEKEI-WKULSOCRSA-N
【SMILES】
c1ccc2c(c1)cccc2OCC(=O)N/N=C/c3cc(ccc3OC(=O)c4ccccc4Cl)Br
【MOL File】
4-BROMO-2-(2-((1-NAP….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-((1-NAPHTHYLOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE.cml