22975-21-9
DIETHYL 2-(2-NITRO-1-PHENYLETHYL)MALONATE
NameDIETHYL 2-(2-NITRO-1-PHENYLETHYL)MALONATE
1Identification
【Name】
DIETHYL 2-(2-NITRO-1-PHENYLETHYL)MALONATE
【CAS】
【MDL】
MFCD02941009
【English Synonyms】
【Formula】
C15 H19 N O6
【MolWeight】
309.316
【Inchi】
InChI=1S/C15H19NO6/c1-3-21-14(17)13(15(18)22-4-2)12(10-16(19)20)11-8-6-5-7-9-11/h5-9,12-13H,3-4,10H2,1-2H3
【InChIKey】
InChIKey=VQKSJEVJSPWVIE-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C(C(C[N+](=O)[O-])c1ccccc1)C(=O)OCC
【MOL File】
DIETHYL 2-(2-NITRO-1….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
DIETHYL 2-(2-NITRO-1-PHENYLETHYL)MALONATE.cml