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Home > Fluorides > 1551174-98-1
1551174-98-1 | "6-fluoro-3,4-dihydro-2H-1,4-benzothiazine"
CAS No: 1551174-98-1 Catalog No: AG01FMSC MDL No:MFCD28149864
Product Description
Catalog Number:
AG01FMSC
Chemical Name:
"6-fluoro-3,4-dihydro-2H-1,4-benzothiazine"
CAS Number:
1551174-98-1
Molecular Formula:
C8H8FNS
Molecular Weight:
169.2192
MDL Number:
MFCD28149864
IUPAC Name:
6-fluoro-3,4-dihydro-2H-1,4-benzothiazine
InChI:
InChI=1S/C8H8FNS/c9-6-1-2-8-7(5-6)10-3-4-11-8/h1-2,5,10H,3-4H2
InChI Key:
YZGYGXCJXWQVRW-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)NCCS2
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.036g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.217g/mol
Monoisotopic Mass:
169.036g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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