220050-44-2
2-BENZOTHIAZOLECARBONITRILE, 7-FLUORO-6-HYDROXY-
Name2-BENZOTHIAZOLECARBONITRILE, 7-FLUORO-6-HYDROXY-
1Identification
【Name】
2-BENZOTHIAZOLECARBONITRILE, 7-FLUORO-6-HYDROXY-
【CAS】
【MDL】
MFCD12964178
【English Synonyms】
【Formula】
C8 H3 F N2 O S
【MolWeight】
194.189
【Inchi】
InChI=1S/C8H3FN2OS/c9-7-5(12)2-1-4-8(7)13-6(3-10)11-4/h1-2,12H
【InChIKey】
InChIKey=ZEZIKQFAQNZIOG-UHFFFAOYSA-N
【SMILES】
c1cc(c(c2c1nc(s2)C#N)F)O
【MOL File】
2-BENZOTHIAZOLECARBO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-BENZOTHIAZOLECARBONITRILE, 7-FLUORO-6-HYDROXY-.cml