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807363-74-2 | 1,3-Dithiolane-4,5-diol
CAS No: 807363-74-2 Catalog No: AG0051PJ MDL No:
Product Description
Catalog Number:
AG0051PJ
Chemical Name:
1,3-Dithiolane-4,5-diol
CAS Number:
807363-74-2
Molecular Formula:
C3H6O2S2
Molecular Weight:
138.2085
IUPAC Name:
1,3-dithiolane-4,5-diol
InChI:
InChI=1S/C3H6O2S2/c4-2-3(5)7-1-6-2/h2-5H,1H2
InChI Key:
UDGYGLJRGXDTBV-UHFFFAOYSA-N
SMILES:
OC1SCSC1O
Properties
Complexity:
60
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.981g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
138.199g/mol
Monoisotopic Mass:
137.981g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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