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Home > Fluorides > 100638-20-8
100638-20-8 | 2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro-
CAS No: 100638-20-8 Catalog No: AG0002JG MDL No:
Product Description
Catalog Number:
AG0002JG
Chemical Name:
2H-1,4-Benzothiazin-3(4H)-one, 7-fluoro-
CAS Number:
100638-20-8
Molecular Formula:
C8H6FNOS
Molecular Weight:
183.2027
IUPAC Name:
7-fluoro-4H-1,4-benzothiazin-3-one
InChI:
InChI=1S/C8H6FNOS/c9-5-1-2-6-7(3-5)12-4-8(11)10-6/h1-3H,4H2,(H,10,11)
InChI Key:
ZRSCIBYAOVOFIG-UHFFFAOYSA-N
SMILES:
O=C1CSc2c(N1)ccc(c2)F
NSC Number:
270530
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.015g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.2g/mol
Monoisotopic Mass:
183.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Literature
| Title | Journal |
|---|---|
| 4H-1,4-benzothiazine, dihydro-1,4-benzothiazinones and 2-amino-5-fluorobenzenethiol derivatives: design, synthesis and in vitro antimicrobial screening. | Archiv der Pharmazie 20120501 |
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