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7028-57-1 | 2-Methyl-2H-1,4-benzothiazin-3(4H)-one, 97%
CAS No: 7028-57-1 Catalog No: AG00FFUY MDL No:MFCD02941599
Product Description
Catalog Number:
AG00FFUY
Chemical Name:
2-Methyl-2H-1,4-benzothiazin-3(4H)-one, 97%
CAS Number:
7028-57-1
MDL Number:
MFCD02941599
IUPAC Name:
2-methyl-4H-1,4-benzothiazin-3-one
InChI:
InChI=1S/C9H9NOS/c1-6-9(11)10-7-4-2-3-5-8(7)12-6/h2-6H,1H3,(H,10,11)
InChI Key:
MCEOSIYJRZMQNS-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:
179.04g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.237g/mol
Monoisotopic Mass:
179.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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