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122243-58-7 | 2,3-Butanedithione
CAS No: 122243-58-7 Catalog No: AG0016Z4 MDL No:
Product Description
Catalog Number:
AG0016Z4
Chemical Name:
2,3-Butanedithione
CAS Number:
122243-58-7
Molecular Formula:
C4H6S2
Molecular Weight:
118.2204
IUPAC Name:
butane-2,3-dithione
InChI:
InChI=1S/C4H6S2/c1-3(5)4(2)6/h1-2H3
InChI Key:
RWMTWVSPJPEEHY-UHFFFAOYSA-N
SMILES:
CC(=S)C(=S)C
Properties
Complexity:
71.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
117.991g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
118.212g/mol
Monoisotopic Mass:
117.991g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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