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Home > Other Heterocycles > 24413-24-9
24413-24-9 | 9-Thiabicyclo[3.3.1]nonane-2,6-dithiol
CAS No: 24413-24-9 Catalog No: AG006V87 MDL No:
Product Description
Catalog Number:
AG006V87
Chemical Name:
9-Thiabicyclo[3.3.1]nonane-2,6-dithiol
CAS Number:
24413-24-9
Molecular Formula:
C8H14S3
Molecular Weight:
206.3918
IUPAC Name:
9-thiabicyclo[3.3.1]nonane-2,6-dithiol
InChI:
InChI=1S/C8H14S3/c9-5-1-3-7-6(10)2-4-8(5)11-7/h5-10H,1-4H2
InChI Key:
GFMPTSJCOVGLDT-UHFFFAOYSA-N
SMILES:
SC1CCC2SC1CCC2S
NSC Number:
98067
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.026g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
206.38g/mol
Monoisotopic Mass:
206.026g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27.3A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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