769151-46-4
4-(2-(3,4-DIMETHOXYBENZOYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-BROMOBENZOATE
Name4-(2-(3,4-DIMETHOXYBENZOYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-BROMOBENZOATE
1Identification
【Name】
4-(2-(3,4-DIMETHOXYBENZOYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-BROMOBENZOATE
【CAS】
【MDL】
MFCD05153675
【English Synonyms】
【Formula】
C24 H21 Br N2 O6
【MolWeight】
513.342
【Inchi】
InChI=1S/C24H21BrN2O6/c1-30-19-10-8-16(13-22(19)32-3)23(28)27-26-14-15-7-9-20(21(11-15)31-2)33-24(29)17-5-4-6-18(25)12-17/h4-14H,1-3H3,(H,27,28)/b26-14+
【InChIKey】
InChIKey=CTZKHROGOXXEPY-VULFUBBASA-N
【SMILES】
COc1ccc(cc1OC)C(=O)N/N=C/c2ccc(c(c2)OC)OC(=O)c3cccc(c3)Br
【MOL File】
4-(2-(3,4-DIMETHOXYB….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-(3,4-DIMETHOXYBENZOYL)CARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-BROMOBENZOATE.cml