769152-75-2
3-(2-(2-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 2,4-DICHLOROBENZOATE
Name3-(2-(2-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 2,4-DICHLOROBENZOATE
1Identification
【Name】
3-(2-(2-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 2,4-DICHLOROBENZOATE
【CAS】
【MDL】
MFCD05153504
【English Synonyms】
【Formula】
C28 H19 Cl3 N2 O4
【MolWeight】
553.827
【Inchi】
InChI=1S/C28H19Cl3N2O4/c29-20-10-8-18(9-11-20)17-36-26-7-2-1-6-24(26)27(34)33-32-16-19-4-3-5-22(14-19)37-28(35)23-13-12-21(30)15-25(23)31/h1-16H,17H2,(H,33,34)/b32-16+
【InChIKey】
InChIKey=BRAOESCONKCLSI-KPGMTVGESA-N
【SMILES】
c1ccc(c(c1)C(=O)N/N=C/c2cccc(c2)OC(=O)c3ccc(cc3Cl)Cl)OCc4ccc(cc4)Cl
【MOL File】
3-(2-(2-((4-CHLOROBE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(2-(2-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 2,4-DICHLOROBENZOATE.cml