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1798766-57-0 | 2-methyl-3,4-dihydro-2H-1,4-benzothiazin-1-one
CAS No: 1798766-57-0 Catalog No: AG01BD7V MDL No:MFCD28012428
Product Description
Catalog Number:
AG01BD7V
Chemical Name:
2-methyl-3,4-dihydro-2H-1,4-benzothiazin-1-one
CAS Number:
1798766-57-0
MDL Number:
MFCD28012428
IUPAC Name:
2-methyl-3,4-dihydro-2H-1λ4,4-benzothiazine 1-oxide
InChI:
InChI=1S/C9H11NOS/c1-7-6-10-8-4-2-3-5-9(8)12(7)11/h2-5,7,10H,6H2,1H3
InChI Key:
ZPGQIOYXLFWFQV-UHFFFAOYSA-N
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.056g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.253g/mol
Monoisotopic Mass:
181.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
48.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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