75032-27-8
ETHYL 2-(4-NITROPHENYLTHIO)ACETATE
NameETHYL 2-(4-NITROPHENYLTHIO)ACETATE
1Identification
【Name】
ETHYL 2-(4-NITROPHENYLTHIO)ACETATE
【CAS】
【MDL】
MFCD12169613
【English Synonyms】
【Formula】
C10 H11 N O4 S
【MolWeight】
241.266
【Inchi】
InChI=1S/C10H11NO4S/c1-2-15-10(12)7-16-9-5-3-8(4-6-9)11(13)14/h3-6H,2,7H2,1H3
【InChIKey】
InChIKey=RUFWJCXCVXSNQN-UHFFFAOYSA-N
【SMILES】
CCOC(=O)CSc1ccc(cc1)[N+](=O)[O-]
【MOL File】
ETHYL 2-(4-NITROPHEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 2-(4-NITROPHENYLTHIO)ACETATE.cml