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Home > Fluorides > 159803-11-9
159803-11-9 | 1,2-Benzisothiazol-3(2H)-one, 6-fluoro-
CAS No: 159803-11-9 Catalog No: AG001RES MDL No:MFCD05859582
Product Description
Catalog Number:
AG001RES
Chemical Name:
1,2-Benzisothiazol-3(2H)-one, 6-fluoro-
CAS Number:
159803-11-9
Molecular Formula:
C7H4FNOS
Molecular Weight:
169.1762
MDL Number:
MFCD05859582
IUPAC Name:
6-fluoro-1,2-benzothiazol-3-one
InChI:
InChI=1S/C7H4FNOS/c8-4-1-2-5-6(3-4)11-9-7(5)10/h1-3H,(H,9,10)
InChI Key:
WLQRIPHXCTXOQC-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)s[nH]c2=O
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.173g/mol
Monoisotopic Mass:
169g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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