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626-04-0

626-04-0 | 1,3-Benzenedithiol

CAS No: 626-04-0 Catalog No: AG0032L8 MDL No:MFCD00004842

Product Description

Catalog Number:
AG0032L8
Chemical Name:
1,3-Benzenedithiol
CAS Number:
626-04-0
Molecular Formula:
C6H6S2
Molecular Weight:
142.2418
MDL Number:
MFCD00004842
IUPAC Name:
benzene-1,3-dithiol
InChI:
InChI=1S/C6H6S2/c7-5-2-1-3-6(8)4-5/h1-4,7-8H
InChI Key:
ZWOASCVFHSYHOB-UHFFFAOYSA-N
SMILES:
Sc1cccc(c1)S
EC Number:
210-925-3

Properties

Complexity:
64.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.991g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
142.234g/mol
Monoisotopic Mass:
141.991g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

Literature

Title Journal
Improved sonolytic hydrolysis of peptides in aqueous solution with addition of 1,4-benzenedithiol. Ultrasonics sonochemistry 20120501
Large-scale atomistic simulations of environmental effects on the formation and properties of molecular junctions. ACS nano 20120327
Freezing the self-assembly process of gold nanocrystals. Chemical communications (Cambridge, England) 20120204
Benzenedithiol: a broad-range single-channel molecular conductor. Nano letters 20110914
Generation of hot spots with silver nanocubes for single-molecule detection by surface-enhanced Raman scattering. Angewandte Chemie (International ed. in English) 20110606
Performance enhancement of hybrid solar cells through chemical vapor annealing. Nano letters 20100512
Self-assembled dynamics of silver nanoparticles and self-assembled dynamics of 1,4-benzenedithiol adsorbed on silver nanoparticles: Surface-enhanced Raman scattering study. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20091001
Adsorption of 1,3-benzenedithiol and 1,3-benzenedimethanethiol on gold surfaces. Chemphyschem : a European journal of chemical physics and physical chemistry 20080825
Acrylate end-capped poly(ester-carbonate) and poly(ether-ester)s for polymer-on-multielectrode array devices: synthesis, photocuring, and biocompatibility. Biomacromolecules 20080301
Molecular origins of conduction channels observed in shot-noise measurements. Nano letters 20061101
In situ scanning tunneling microscopy of 1,6-hexanedithiol, 1,9-nonanedithiol, 1,2-benzenedithiol, and 1,3-benzenedithiol adsorbed on pt(111) electrodes. Langmuir : the ACS journal of surfaces and colloids 20060523
Electrical transport study of phenylene-based pi-conjugated molecules in a three-terminal geometry. Annals of the New York Academy of Sciences 20031201

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