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Home > Other Heterocycles > 176-72-7
176-72-7 | 2,3-Dithiaspiro[4.5]decane (6CI,7CI,8CI,9CI)
CAS No: 176-72-7 Catalog No: AG0021D1 MDL No:
Product Description
Catalog Number:
AG0021D1
Chemical Name:
2,3-Dithiaspiro[4.5]decane (6CI,7CI,8CI,9CI)
CAS Number:
176-72-7
Molecular Formula:
C8H14S2
Molecular Weight:
174.3268
IUPAC Name:
2,3-dithiaspiro[4.5]decane
InChI:
InChI=1S/C8H14S2/c1-2-4-8(5-3-1)6-9-10-7-8/h1-7H2
InChI Key:
HAXVUMKRJJJVDO-UHFFFAOYSA-N
SMILES:
C1CCC2(CC1)CSSC2
NSC Number:
243161
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.054g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.32g/mol
Monoisotopic Mass:
174.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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