765296-69-3
2-(2-(2-((4-BR-BENZYL)OXY)BENZYLIDENE)HYDRAZINO)-N-(3,4-DI-CL-PH)-2-OXOACETAMIDE
Name2-(2-(2-((4-BR-BENZYL)OXY)BENZYLIDENE)HYDRAZINO)-N-(3,4-DI-CL-PH)-2-OXOACETAMIDE
FormulaC22 H16 Br Cl2 N3 O3
1Identification
【Name】
2-(2-(2-((4-BR-BENZYL)OXY)BENZYLIDENE)HYDRAZINO)-N-(3,4-DI-CL-PH)-2-OXOACETAMIDE
【CAS】
【MDL】
MFCD06199698
【English Synonyms】
【Formula】
C22 H16 Br Cl2 N3 O3
【MolWeight】
521.196
【Inchi】
InChI=1S/C22H16BrCl2N3O3/c23-16-7-5-14(6-8-16)13-31-20-4-2-1-3-15(20)12-26-28-22(30)21(29)27-17-9-10-18(24)19(25)11-17/h1-12H,13H2,(H,27,29)(H,28,30)/b26-12+
【InChIKey】
InChIKey=PEUQCKWOOXADKF-RPPGKUMJSA-N
【SMILES】
c1ccc(c(c1)/C=N/NC(=O)C(=O)Nc2ccc(c(c2)Cl)Cl)OCc3ccc(cc3)Br
【MOL File】
2-(2-(2-((4-BR-BENZY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(2-(2-((4-BR-BENZYL)OXY)BENZYLIDENE)HYDRAZINO)-N-(3,4-DI-CL-PH)-2-OXOACETAMIDE.cml