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Home Other Building Blocks 1,4-BUTANEDITHIOL

1,4-BUTANEDITHIOL

CAS No.:
1191-08-8
Catalog Number:
AG000I6V
Molecular Formula:
C4H10S2
Molecular Weight:
122.2522
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
99%
1 week
United States
$53
- +
5g
99%
1 week
United States
$73
- +
25g
99%
1 week
United States
$121
- +
100g
99%
1 week
United States
$205
- +
Product Description
Catalog Number:
AG000I6V
Chemical Name:
1,4-BUTANEDITHIOL
CAS Number:
1191-08-8
Molecular Formula:
C4H10S2
Molecular Weight:
122.2522
MDL Number:
MFCD00004906
IUPAC Name:
butane-1,4-dithiol
InChI:
InChI=1S/C4H10S2/c5-3-1-2-4-6/h5-6H,1-4H2
InChI Key:
SMTOKHQOVJRXLK-UHFFFAOYSA-N
SMILES:
SCCCCS
EC Number:
214-728-3
UNII:
7JD227IUMC
NSC Number:
60198
Properties
Complexity:
17.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.022g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
122.244g/mol
Monoisotopic Mass:
122.022g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Interstaple dithiol cross-linking in Au25(SR)18 nanomolecules: a combined mass spectrometric and computational study. Journal of the American Chemical Society 20111221
On the thermodynamic stability of alpha,omega-alkanedithiols self-assembled monolayers on unreconstructed and reconstructed Au(111). Langmuir : the ACS journal of surfaces and colloids 20100615
Deposition of gold nanoparticles onto thiol-functionalized multiwalled carbon nanotubes. The journal of physical chemistry. B 20050901
Gating of enhanced electron-charging thresholds in self-assembled nanoparticle films. The journal of physical chemistry. B 20050818
The RS-.HSR Hydrogen Bond: acidities of alpha,omega-dithiols and electron affinities of their monoradicals. Journal of the American Chemical Society 20011010
Properties