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Decane-1,10-dithiol

CAT: 0013-GTR19201875-02Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19201875-02Size:100 mg
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Description
Decane-1,10-dithiol is a versatile bifunctional thiol compound used as a key intermediate in organic synthesis. It serves as a molecular linker in materials science and is utilized in biochemical research for the functionalization of nanoparticles and surfaces in vitro.
CAS Number
1191-67-9
Smiles
SCCCCCCCCCCS
Molecular Formula
C10H22S2
Molecular Weight
206.41
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1,10-Decanedithiol
CAS Number1191-67-9
PubChem CID14494
IUPAC Namedecane-1,10-dithiol
Molecular FormulaC10H22S2
Molecular Weight206.4
XLogP4.4
Topological Polar Surface Area2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count9
Heavy Atom Count12
Formal Charge0
Complexity64
SMILES
C(CCCCCS)CCCCS
InChI
InChI=1S/C10H22S2/c11-9-7-5-3-1-2-4-6-8-10-12/h11-12H,1-10H2
InChIKey
UOQACRNTVQWTFF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,10-Decanedithiol
CAS: 1191-67-9
CID: 14494
Formula: C10H22S2
MW: 206.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight206.4
XLogP34.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count9
Exact Mass206.11629305
Monoisotopic Mass206.11629305
Topological Polar Surface Area2 Ų
Heavy Atom Count12
Formal Charge0
Complexity64.2
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
581826Decane-1,10-dithiol
T21134Decane, 1,10-diiodo-
T31317-01Decane, 1,10-difluoro-
581798Decane, 1,10-dichloro-
581803Decane, 1,10-dibromo-
HY-W016871Decane-1,10-diamine
T31316-01Decane, 1,10-bis (methylsulfinyl) -
D2263411,10-Decane-d20-diol
T31319-01Decane, 1-bromo-10-fluoro-
T31320-01Decane, 1-chloro-10-fluoro-

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