765276-48-0
4-(2-(2-CHLOROBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-BROMOBENZOATE
Name4-(2-(2-CHLOROBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-BROMOBENZOATE
FormulaC21 H14 Br Cl N2 O3
1Identification
【Name】
4-(2-(2-CHLOROBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-BROMOBENZOATE
【CAS】
【MDL】
MFCD05720560
【English Synonyms】
【Formula】
C21 H14 Br Cl N2 O3
【MolWeight】
457.71
【Inchi】
InChI=1S/C21H14BrClN2O3/c22-18-7-3-1-5-16(18)21(27)28-15-11-9-14(10-12-15)13-24-25-20(26)17-6-2-4-8-19(17)23/h1-13H,(H,25,26)/b24-13+
【InChIKey】
InChIKey=JTARHPLJRCYXPF-ZMOGYAJESA-N
【SMILES】
c1ccc(c(c1)C(=O)N/N=C/c2ccc(cc2)OC(=O)c3ccccc3Br)Cl
【MOL File】
4-(2-(2-CHLOROBENZOY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-(2-CHLOROBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-BROMOBENZOATE.cml