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Home > Other Heterocycles > 16775-67-0
16775-67-0 | 1,4-Dithiaspiro[4.11]hexadecane
CAS No: 16775-67-0 Catalog No: AG001XK9 MDL No:
Product Description
Catalog Number:
AG001XK9
Chemical Name:
1,4-Dithiaspiro[4.11]hexadecane
CAS Number:
16775-67-0
Molecular Formula:
C14H26S2
Molecular Weight:
258.4862
IUPAC Name:
1,4-dithiaspiro[4.11]hexadecane
InChI:
InChI=1S/C14H26S2/c1-2-4-6-8-10-14(15-12-13-16-14)11-9-7-5-3-1/h1-13H2
InChI Key:
BSFZPGSAVXOWPF-UHFFFAOYSA-N
SMILES:
C1CCCCCCCC2(CCC1)SCCS2
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.148g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.482g/mol
Monoisotopic Mass:
258.148g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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