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Home > Other Heterocycles > 18543-35-6
18543-35-6 | SPIRO[BICYCLO[3.1.1]HEPTANE-6,2'-[1,3]- DITHIOLANE]
CAS No: 18543-35-6 Catalog No: AG007764 MDL No:
Product Description
Catalog Number:
AG007764
Chemical Name:
SPIRO[BICYCLO[3.1.1]HEPTANE-6,2'-[1,3]- DITHIOLANE]
CAS Number:
18543-35-6
Molecular Formula:
C9H14S2
Molecular Weight:
186.3375
IUPAC Name:
spiro[1,3-dithiolane-2,6'-bicyclo[3.1.1]heptane]
InChI:
InChI=1S/C9H14S2/c1-2-7-6-8(3-1)9(7)10-4-5-11-9/h7-8H,1-6H2
InChI Key:
BHOOPRTZHKLIQY-UHFFFAOYSA-N
SMILES:
C1CC2CC(C1)C12SCCS1
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.054g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.331g/mol
Monoisotopic Mass:
186.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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