Home Other Building Blocks 1,2-BENZENEDITHIOL

1,2-BENZENEDITHIOL

CAS No.:
17534-15-5
Catalog Number:
AG0020XC
Molecular Formula:
C6H6S2
Molecular Weight:
142.2418
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Product Description
Catalog Number:
AG0020XC
Chemical Name:
1,2-BENZENEDITHIOL
CAS Number:
17534-15-5
Molecular Formula:
C6H6S2
Molecular Weight:
142.2418
MDL Number:
MFCD00004835
IUPAC Name:
benzene-1,2-dithiol
InChI:
InChI=1S/C6H6S2/c7-5-3-1-2-4-6(5)8/h1-4,7-8H
InChI Key:
JRNVQLOKVMWBFR-UHFFFAOYSA-N
SMILES:
Sc1ccccc1S
EC Number:
241-530-4
NSC Number:
623558
Properties
Complexity:
62.9  
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
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Properties