731002-02-1
ETHYL (4-[(DIETHYLAMINO)SULFONYL]-2-NITROPHENOXY)ACETATE
NameETHYL (4-[(DIETHYLAMINO)SULFONYL]-2-NITROPHENOXY)ACETATE
1Identification
【Name】
ETHYL (4-[(DIETHYLAMINO)SULFONYL]-2-NITROPHENOXY)ACETATE
【CAS】
【MDL】
MFCD04625441
【English Synonyms】
【Formula】
C14 H20 N2 O7 S
【MolWeight】
360.385
【Inchi】
InChI=1S/C14H20N2O7S/c1-4-15(5-2)24(20,21)11-7-8-13(12(9-11)16(18)19)23-10-14(17)22-6-3/h7-9H,4-6,10H2,1-3H3
【InChIKey】
InChIKey=TZEQFXLNTIIJOR-UHFFFAOYSA-N
【SMILES】
CCN(CC)S(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])OCC(=O)OCC
【MOL File】
ETHYL (4-[(DIETHYLAM….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:9
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL (4-[(DIETHYLAMINO)SULFONYL]-2-NITROPHENOXY)ACETATE.cml