765287-71-6
2(2(2-((1,1'-BI-PH)-4-YLOXY)PROPANOYL)CARBOHYDRAZONOYL)4-BR-PH 4-METHOXYBENZOATE
Name2(2(2-((1,1'-BI-PH)-4-YLOXY)PROPANOYL)CARBOHYDRAZONOYL)4-BR-PH 4-METHOXYBENZOATE
1Identification
【Name】
2(2(2-((1,1'-BI-PH)-4-YLOXY)PROPANOYL)CARBOHYDRAZONOYL)4-BR-PH 4-METHOXYBENZOATE
【CAS】
【MDL】
MFCD06200077
【English Synonyms】
【Formula】
C30 H25 Br N2 O5
【MolWeight】
573.44
【Inchi】
InChI=1S/C30H25BrN2O5/c1-20(37-27-15-8-22(9-16-27)21-6-4-3-5-7-21)29(34)33-32-19-24-18-25(31)12-17-28(24)38-30(35)23-10-13-26(36-2)14-11-23/h3-20H,1-2H3,(H,33,34)/b32-19+
【InChIKey】
InChIKey=PAVGUXJAALAQFC-BIZUNTBRSA-N
【SMILES】
CC(C(=O)N/N=C/c1cc(ccc1OC(=O)c2ccc(cc2)OC)Br)Oc3ccc(cc3)c4ccccc4
【MOL File】
2(2(2-((1,1'-BI-PH)-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2(2(2-((1,1'-BI-PH)-4-YLOXY)PROPANOYL)CARBOHYDRAZONOYL)4-BR-PH 4-METHOXYBENZOATE.cml