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123796-48-5 | 2-Thiiranethione
CAS No: 123796-48-5 Catalog No: AG000L3U MDL No:
Product Description
Catalog Number:
AG000L3U
Chemical Name:
2-Thiiranethione
CAS Number:
123796-48-5
Molecular Formula:
C2H2S2
Molecular Weight:
90.1673
IUPAC Name:
thiirane-2-thione
InChI:
InChI=1S/C2H2S2/c3-2-1-4-2/h1H2
InChI Key:
OZDVIUBHMMUFSU-UHFFFAOYSA-N
SMILES:
C1SC1=S
Properties
Complexity:
48
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
89.96g/mol
Formal Charge:
0
Heavy Atom Count:
4
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
90.158g/mol
Monoisotopic Mass:
89.96g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| Synthesis of isolable thiirane-2-thione (alpha-dithiolactone) from thioketene S-oxide. | Journal of the American Chemical Society 20040811 |
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