769150-85-8
4-BROMO-2-(2-(2-HYDROXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE
Name4-BROMO-2-(2-(2-HYDROXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE
1Identification
【Name】
4-BROMO-2-(2-(2-HYDROXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE
【CAS】
【MDL】
MFCD05153914
【English Synonyms】
【Formula】
C22 H17 Br N2 O5
【MolWeight】
469.289
【Inchi】
InChI=1S/C22H17BrN2O5/c1-29-17-9-6-14(7-10-17)22(28)30-20-11-8-16(23)12-15(20)13-24-25-21(27)18-4-2-3-5-19(18)26/h2-13,26H,1H3,(H,25,27)/b24-13+
【InChIKey】
InChIKey=UVGUHJXNGASBRV-ZMOGYAJESA-N
【SMILES】
COc1ccc(cc1)C(=O)Oc2ccc(cc2/C=N/NC(=O)c3ccccc3O)Br
【MOL File】
4-BROMO-2-(2-(2-HYDR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-BROMO-2-(2-(2-HYDROXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE.cml