595575-15-8
4-BROMO-2-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL BENZOATE
Name4-BROMO-2-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL BENZOATE
FormulaC28 H20 Br Cl N2 O4
1Identification
【Name】
4-BROMO-2-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL BENZOATE
【CAS】
【MDL】
MFCD03328913
【English Synonyms】
【Formula】
C28 H20 Br Cl N2 O4
【MolWeight】
563.833
【Inchi】
InChI=1S/C28H20BrClN2O4/c29-23-10-15-26(36-28(34)21-4-2-1-3-5-21)22(16-23)17-31-32-27(33)20-8-13-25(14-9-20)35-18-19-6-11-24(30)12-7-19/h1-17H,18H2,(H,32,33)/b31-17+
【InChIKey】
InChIKey=OLONDGTWADBUJT-KBVAKVRCSA-N
【SMILES】
c1ccc(cc1)C(=O)Oc2ccc(cc2/C=N/NC(=O)c3ccc(cc3)OCc4ccc(cc4)Cl)Br
【MOL File】
4-BROMO-2-(2-(4-((4-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-BROMO-2-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL BENZOATE.cml