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1934600-46-0

1934600-46-0 | 4H,6H,7H-5lambda6-furo[2,3-d][1,2]thiazine-5,5,7-trione

CAS No: 1934600-46-0 Catalog No: AG01C3BI MDL No:

Product Description

Catalog Number:
AG01C3BI
Chemical Name:
4H,6H,7H-5lambda6-furo[2,3-d][1,2]thiazine-5,5,7-trione
CAS Number:
1934600-46-0
Molecular Formula:
C6H5NO4S
Molecular Weight:
187.1732
IUPAC Name:
5,5-dioxo-4H-furo[2,3-d]thiazin-7-one
InChI:
InChI=1S/C6H5NO4S/c8-6-5-4(1-2-11-5)3-12(9,10)7-6/h1-2H,3H2,(H,7,8)
InChI Key:
GHHXPHNNFHVROQ-UHFFFAOYSA-N
SMILES:
O=C1NS(=O)(=O)Cc2c1occ2

Properties

Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.994g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.169g/mol
Monoisotopic Mass:
186.994g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  

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