765287-96-5
4-BROMO-2-(2-((3,4-DIMETHYLPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL BENZOATE
Name4-BROMO-2-(2-((3,4-DIMETHYLPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL BENZOATE
1Identification
【Name】
4-BROMO-2-(2-((3,4-DIMETHYLPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL BENZOATE
【CAS】
【MDL】
MFCD06200073
【English Synonyms】
【Formula】
C24 H21 Br N2 O4
【MolWeight】
481.344
【Inchi】
InChI=1S/C24H21BrN2O4/c1-16-8-10-21(12-17(16)2)30-15-23(28)27-26-14-19-13-20(25)9-11-22(19)31-24(29)18-6-4-3-5-7-18/h3-14H,15H2,1-2H3,(H,27,28)/b26-14+
【InChIKey】
InChIKey=NAUOVXKFJOMSFO-VULFUBBASA-N
【SMILES】
Cc1ccc(cc1C)OCC(=O)N/N=C/c2cc(ccc2OC(=O)c3ccccc3)Br
【MOL File】
4-BROMO-2-(2-((3,4-D….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-BROMO-2-(2-((3,4-DIMETHYLPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL BENZOATE.cml