767312-40-3
4-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 3-PHENYLACRYLATE
Name4-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 3-PHENYLACRYLATE
1Identification
【Name】
4-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 3-PHENYLACRYLATE
【CAS】
【MDL】
MFCD05720801
【English Synonyms】
【Formula】
C30 H23 Cl N2 O4
【MolWeight】
510.975
【Inchi】
InChI=1S/C30H23ClN2O4/c31-26-13-6-24(7-14-26)21-36-27-17-11-25(12-18-27)30(35)33-32-20-23-8-15-28(16-9-23)37-29(34)19-10-22-4-2-1-3-5-22/h1-20H,21H2,(H,33,35)/b19-10+,32-20+
【InChIKey】
InChIKey=LVMUKMVJVOTAGO-NSMFXTPDSA-N
【SMILES】
c1ccc(cc1)/C=C/C(=O)Oc2ccc(cc2)/C=N/NC(=O)c3ccc(cc3)OCc4ccc(cc4)Cl
【MOL File】
4-(2-(4-((4-CHLOROBE….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-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 3-PHENYLACRYLATE.cml