764669-44-5
4-BROMO-2-(2-(2-METHOXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
Name4-BROMO-2-(2-(2-METHOXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
FormulaC22 H16 Br Cl N2 O4
1Identification
【Name】
4-BROMO-2-(2-(2-METHOXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
【CAS】
【MDL】
MFCD06200189
【English Synonyms】
【Formula】
C22 H16 Br Cl N2 O4
【MolWeight】
487.735
【Inchi】
InChI=1S/C22H16BrClN2O4/c1-29-20-5-3-2-4-18(20)21(27)26-25-13-15-12-16(23)8-11-19(15)30-22(28)14-6-9-17(24)10-7-14/h2-13H,1H3,(H,26,27)/b25-13+
【InChIKey】
InChIKey=YHNKHZCESOLXFQ-DHRITJCHSA-N
【SMILES】
COc1ccccc1C(=O)N/N=C/c2cc(ccc2OC(=O)c3ccc(cc3)Cl)Br
【MOL File】
4-BROMO-2-(2-(2-METH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-BROMO-2-(2-(2-METHOXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE.cml