463361-84-4
3-(9-fluoro-2,3,3a,4-tetrahydro-1H-5-oxa-9b-aza-cyclopenta[a]naphthalen-7-yl)-5-isothiocyanatomethyl-oxazolidin-2-one
Name3-(9-fluoro-2,3,3a,4-tetrahydro-1H-5-oxa-9b-aza-cyclopenta[a]naphthalen-7-yl)-5-isothiocyanatomethyl-oxazolidin-2-one
1Identification
【Name】
3-(9-fluoro-2,3,3a,4-tetrahydro-1H-5-oxa-9b-aza-cyclopenta[a]naphthalen-7-yl)-5-isothiocyanatomethyl-oxazolidin-2-one
【CAS】
【MDL】
【English Synonyms】
【Formula】
C16H16FN3O3S
【MolWeight】
349.38
【Inchi】
InChI=1S/C16H16FN3O3S/c17-13-4-11(20-7-12(6-18-9-24)23-16(20)21)5-14-15(13)19-3-1-2-10(19)8-22-14/h4-5,10,12H,1-3,6-8H2
【InChIKey】
InChIKey=PKLRURSVRADUDC-UHFFFAOYSA-N
【SMILES】
FC=1C=C(C=C2OCC3N(C12)CCC3)N3C(OC(C3)CN=C=S)=O
【MOL File】
3-(9-fluoro-2,3,3a,4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
3-(9-fluoro-2,3,3a,4-tetrahydro-1H-5-oxa-9b-aza-cyclopenta[a]naphthalen-7-yl)-5-isothiocyanatomethyl-oxazolidin-2-one.cml