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202126-51-0 | [1,3]Dithiolo[4,5-d]-1,3-dithiole-2-thione, 5-hexyl-
CAS No: 202126-51-0 Catalog No: AG00282G MDL No:
Product Description
Catalog Number:
AG00282G
Chemical Name:
[1,3]Dithiolo[4,5-d]-1,3-dithiole-2-thione, 5-hexyl-
CAS Number:
202126-51-0
Molecular Formula:
C10H14S5
Molecular Weight:
294.5432
IUPAC Name:
2-hexyl-[1,3]dithiolo[4,5-d][1,3]dithiole-5-thione
InChI:
InChI=1S/C10H14S5/c1-2-3-4-5-6-7-12-8-9(13-7)15-10(11)14-8/h7H,2-6H2,1H3
InChI Key:
RMWMTOWGAZGYGL-UHFFFAOYSA-N
SMILES:
CCCCCCC1Sc2c(S1)sc(=S)s2
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.97g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.522g/mol
Monoisotopic Mass:
293.97g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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