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Home > Thiazole > 1803571-20-1
1803571-20-1 | 7-hydroxy-6,8-dimethoxy-3,4-dihydro-2H-1,2-benzothiazine-1,1,3-trione
CAS No: 1803571-20-1 Catalog No: AG01BGCS MDL No:MFCD28118876
Product Description
Catalog Number:
AG01BGCS
Chemical Name:
7-hydroxy-6,8-dimethoxy-3,4-dihydro-2H-1,2-benzothiazine-1,1,3-trione
CAS Number:
1803571-20-1
Molecular Formula:
C10H11NO6S
Molecular Weight:
273.2624
MDL Number:
MFCD28118876
IUPAC Name:
7-hydroxy-6,8-dimethoxy-1,1-dioxo-4H-1λ6,2-benzothiazin-3-one
InChI:
InChI=1S/C10H11NO6S/c1-16-6-3-5-4-7(12)11-18(14,15)10(5)9(17-2)8(6)13/h3,13H,4H2,1-2H3,(H,11,12)
InChI Key:
MMBQMTFKONGECY-UHFFFAOYSA-N
SMILES:
COc1cc2CC(=O)NS(=O)(=O)c2c(c1O)OC
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.031g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
273.259g/mol
Monoisotopic Mass:
273.031g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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