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Home > Other Heterocycles > 51616-76-3
51616-76-3 | 2,4-Dithiabicyclo[1.1.0]butane
CAS No: 51616-76-3 Catalog No: AG006URP MDL No:
Product Description
Catalog Number:
AG006URP
Chemical Name:
2,4-Dithiabicyclo[1.1.0]butane
CAS Number:
51616-76-3
Molecular Formula:
C2H2S2
Molecular Weight:
90.1673
IUPAC Name:
2,4-dithiabicyclo[1.1.0]butane
InChI:
InChI=1S/C2H2S2/c3-1-2(3)4-1/h1-2H
InChI Key:
FDXIEOKTRJUELP-UHFFFAOYSA-N
SMILES:
S1C2C1S2
Properties
Complexity:
36
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:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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