765310-72-3
4-BROMO-2-(2-((2-METHOXYPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL BENZOATE
Name4-BROMO-2-(2-((2-METHOXYPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL BENZOATE
1Identification
【Name】
4-BROMO-2-(2-((2-METHOXYPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL BENZOATE
【CAS】
【MDL】
MFCD06200018
【English Synonyms】
【Formula】
C23 H19 Br N2 O5
【MolWeight】
483.316
【Inchi】
InChI=1S/C23H19BrN2O5/c1-29-20-9-5-6-10-21(20)30-15-22(27)26-25-14-17-13-18(24)11-12-19(17)31-23(28)16-7-3-2-4-8-16/h2-14H,15H2,1H3,(H,26,27)/b25-14+
【InChIKey】
InChIKey=IMSFUPFGGCOCLW-AFUMVMLFSA-N
【SMILES】
COc1ccccc1OCC(=O)N/N=C/c2cc(ccc2OC(=O)c3ccccc3)Br
【MOL File】
4-BROMO-2-(2-((2-MET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-BROMO-2-(2-((2-METHOXYPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL BENZOATE.cml