767320-48-9
4-(2-(2-(4-NITROPHENOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 3,4-DIMETHOXYBENZOATE
Name4-(2-(2-(4-NITROPHENOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 3,4-DIMETHOXYBENZOATE
1Identification
【Name】
4-(2-(2-(4-NITROPHENOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 3,4-DIMETHOXYBENZOATE
【CAS】
【MDL】
MFCD05154455
【English Synonyms】
【Formula】
C25 H23 N3 O8
【MolWeight】
493.47
【Inchi】
InChI=1S/C25H23N3O8/c1-16(35-20-11-7-19(8-12-20)28(31)32)24(29)27-26-15-17-4-9-21(10-5-17)36-25(30)18-6-13-22(33-2)23(14-18)34-3/h4-16H,1-3H3,(H,27,29)/b26-15+
【InChIKey】
InChIKey=LBUSECCJUKGOQA-CVKSISIWSA-N
【SMILES】
CC(C(=O)N/N=C/c1ccc(cc1)OC(=O)c2ccc(c(c2)OC)OC)Oc3ccc(cc3)[N+](=O)[O-]
【MOL File】
4-(2-(2-(4-NITROPHEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:11
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-(2-(4-NITROPHENOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 3,4-DIMETHOXYBENZOATE.cml