767339-41-3
4-(2-(3-BROMOBENZOYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-PHENYLACRYLATE
Name4-(2-(3-BROMOBENZOYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-PHENYLACRYLATE
1Identification
【Name】
4-(2-(3-BROMOBENZOYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-PHENYLACRYLATE
【CAS】
【MDL】
MFCD05151981
【English Synonyms】
【Formula】
C24 H19 Br N2 O4
【MolWeight】
479.328
【Inchi】
InChI=1S/C24H19BrN2O4/c1-30-22-14-18(16-26-27-24(29)19-8-5-9-20(25)15-19)10-12-21(22)31-23(28)13-11-17-6-3-2-4-7-17/h2-16H,1H3,(H,27,29)/b13-11+,26-16+
【InChIKey】
InChIKey=WYJRDVZVVHVASJ-OQUGPSRRSA-N
【SMILES】
COc1cc(ccc1OC(=O)/C=C/c2ccccc2)/C=N/NC(=O)c3cccc(c3)Br
【MOL File】
4-(2-(3-BROMOBENZOYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-(3-BROMOBENZOYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-PHENYLACRYLATE.cml