765310-54-1
4-BROMO-2-(2-(4-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
Name4-BROMO-2-(2-(4-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
FormulaC22 H16 Br Cl N2 O3
1Identification
【Name】
4-BROMO-2-(2-(4-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
【CAS】
【MDL】
MFCD05153801
【English Synonyms】
【Formula】
C22 H16 Br Cl N2 O3
【MolWeight】
471.736
【Inchi】
InChI=1S/C22H16BrClN2O3/c1-14-6-8-15(9-7-14)21(27)26-25-13-16-12-17(23)10-11-20(16)29-22(28)18-4-2-3-5-19(18)24/h2-13H,1H3,(H,26,27)/b25-13+
【InChIKey】
InChIKey=JXJSTXCQUQJEPW-DHRITJCHSA-N
【SMILES】
Cc1ccc(cc1)C(=O)N/N=C/c2cc(ccc2OC(=O)c3ccccc3Cl)Br
【MOL File】
4-BROMO-2-(2-(4-METH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-BROMO-2-(2-(4-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE.cml