767320-47-8
4-BROMO-2-(2-(1-NAPHTHYLACETYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
Name4-BROMO-2-(2-(1-NAPHTHYLACETYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
FormulaC26 H18 Br Cl N2 O3
1Identification
【Name】
4-BROMO-2-(2-(1-NAPHTHYLACETYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
【CAS】
【MDL】
MFCD05154456
【English Synonyms】
【Formula】
C26 H18 Br Cl N2 O3
【MolWeight】
521.796
【Inchi】
InChI=1S/C26H18BrClN2O3/c27-21-10-13-24(33-26(32)18-8-11-22(28)12-9-18)20(14-21)16-29-30-25(31)15-19-6-3-5-17-4-1-2-7-23(17)19/h1-14,16H,15H2,(H,30,31)/b29-16+
【InChIKey】
InChIKey=FKVCDCPKXYBUPM-MUFRIFMGSA-N
【SMILES】
c1ccc2c(c1)cccc2CC(=O)N/N=C/c3cc(ccc3OC(=O)c4ccc(cc4)Cl)Br
【MOL File】
4-BROMO-2-(2-(1-NAPH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-BROMO-2-(2-(1-NAPHTHYLACETYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE.cml