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Home > Thiazole > 1094107-95-5
1094107-95-5 | 3-oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-7-carbonitrile
CAS No: 1094107-95-5 Catalog No: AG0091P8 MDL No:
Product Description
Catalog Number:
AG0091P8
Chemical Name:
3-oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-7-carbonitrile
CAS Number:
1094107-95-5
IUPAC Name:
3-oxo-4H-1,4-benzothiazine-7-carbonitrile
InChI:
InChI=1S/C9H6N2OS/c10-4-6-1-2-7-8(3-6)13-5-9(12)11-7/h1-3H,5H2,(H,11,12)
InChI Key:
ATNXHMJGNVYBLN-UHFFFAOYSA-N
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.02g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.22g/mol
Monoisotopic Mass:
190.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
78.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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