Home Other Building Blocks 2,3-dihydro-1lambda6-thiophene-1,1,3-trione

2,3-dihydro-1lambda6-thiophene-1,1,3-trione

CAS No.:
87419-51-0
Catalog Number:
AG01BS81
Molecular Formula:
C4H4O3S
Molecular Weight:
132.1378
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Product Description
Catalog Number:
AG01BS81
Chemical Name:
2,3-dihydro-1lambda6-thiophene-1,1,3-trione
CAS Number:
87419-51-0
Molecular Formula:
C4H4O3S
Molecular Weight:
132.1378
MDL Number:
MFCD24688277
IUPAC Name:
1,1-dioxothiophen-3-one
InChI:
InChI=1S/C4H4O3S/c5-4-1-2-8(6,7)3-4/h1-2H,3H2
InChI Key:
CHGIHNHFMQGPDX-UHFFFAOYSA-N
SMILES:
O=C1C=CS(=O)(=O)C1
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.988g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.133g/mol
Monoisotopic Mass:
131.988g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties