477734-23-9
4-(2-((2-CHLOROPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-BROMOBENZOATE
Name4-(2-((2-CHLOROPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-BROMOBENZOATE
FormulaC22 H16 Br Cl N2 O4
1Identification
【Name】
4-(2-((2-CHLOROPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-BROMOBENZOATE
【CAS】
【MDL】
MFCD00646550
【English Synonyms】
【Formula】
C22 H16 Br Cl N2 O4
【MolWeight】
487.735
【Inchi】
InChI=1S/C22H16BrClN2O4/c23-17-9-7-16(8-10-17)22(28)30-18-11-5-15(6-12-18)13-25-26-21(27)14-29-20-4-2-1-3-19(20)24/h1-13H,14H2,(H,26,27)/b25-13+
【InChIKey】
InChIKey=GVYCFHOJUFDMTP-DHRITJCHSA-N
【SMILES】
c1ccc(c(c1)OCC(=O)N/N=C/c2ccc(cc2)OC(=O)c3ccc(cc3)Br)Cl
【MOL File】
4-(2-((2-CHLOROPHENO….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-((2-CHLOROPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-BROMOBENZOATE.cml