145079-07-8
ETHYL 4-(3-NITROPYRIDIN-4-YLAMINO)BENZOATE
NameETHYL 4-(3-NITROPYRIDIN-4-YLAMINO)BENZOATE
1Identification
【Name】
ETHYL 4-(3-NITROPYRIDIN-4-YLAMINO)BENZOATE
【CAS】
【MDL】
MFCD01106367
【English Synonyms】
【Formula】
C14 H13 N3 O4
【MolWeight】
287.274
【Inchi】
InChI=1S/C14H13N3O4/c1-2-21-14(18)10-3-5-11(6-4-10)16-12-7-8-15-9-13(12)17(19)20/h3-9H,2H2,1H3,(H,15,16)
【InChIKey】
InChIKey=FSQOLWFPBSQEJP-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1ccc(cc1)Nc2ccncc2[N+](=O)[O-]
【MOL File】
ETHYL 4-(3-NITROPYRI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 4-(3-NITROPYRIDIN-4-YLAMINO)BENZOATE.cml