767305-60-2
2-METHOXY-4-(2-(1-NAPHTHOYL)CARBOHYDRAZONOYL)PHENYL 3-BROMOBENZOATE
Name2-METHOXY-4-(2-(1-NAPHTHOYL)CARBOHYDRAZONOYL)PHENYL 3-BROMOBENZOATE
1Identification
【Name】
2-METHOXY-4-(2-(1-NAPHTHOYL)CARBOHYDRAZONOYL)PHENYL 3-BROMOBENZOATE
【CAS】
【MDL】
MFCD05720963
【English Synonyms】
【Formula】
C26 H19 Br N2 O4
【MolWeight】
503.35
【Inchi】
InChI=1S/C26H19BrN2O4/c1-32-24-14-17(12-13-23(24)33-26(31)19-8-4-9-20(27)15-19)16-28-29-25(30)22-11-5-7-18-6-2-3-10-21(18)22/h2-16H,1H3,(H,29,30)/b28-16+
【InChIKey】
InChIKey=JPHMDODOLRIKQF-LQKURTRISA-N
【SMILES】
COc1cc(ccc1OC(=O)c2cccc(c2)Br)/C=N/NC(=O)c3cccc4c3cccc4
【MOL File】
2-METHOXY-4-(2-(1-NA….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
2-METHOXY-4-(2-(1-NAPHTHOYL)CARBOHYDRAZONOYL)PHENYL 3-BROMOBENZOATE.cml