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1618-26-4 | Methane, bis(methylthio)-
CAS No: 1618-26-4 Catalog No: AG001VX5 MDL No:MFCD00008564
Product Description
Catalog Number:
AG001VX5
Chemical Name:
Methane, bis(methylthio)-
CAS Number:
1618-26-4
Molecular Formula:
C3H8S2
Molecular Weight:
108.2256
MDL Number:
MFCD00008564
IUPAC Name:
bis(methylsulfanyl)methane
InChI:
InChI=1S/C3H8S2/c1-4-3-5-2/h3H2,1-2H3
InChI Key:
LOCDPORVFVOGCR-UHFFFAOYSA-N
SMILES:
CSCSC
EC Number:
216-577-9
UNII:
128SGX814T
NSC Number:
96010
FEMA Number:
3878
Properties
Complexity:
12.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
108.007g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
108.217g/mol
Monoisotopic Mass:
108.007g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Molecular conformations and the liquid structure in bis(methylthio)methane and diethyl sulfide: diffraction experiments vs molecular dynamics simulations. | The journal of physical chemistry. B 20120802 |
| Gold(I)-dithioether supramolecular polymers: synthesis, characterization, and luminescence. | Inorganic chemistry 20080421 |
| One-dimensional coordination polymers incorporating silver(I) perfluorocarboxylate cuboctahedral clusters and the bis(methylthio)methane ligand. | Inorganic chemistry 20070416 |
| Zapoteca formosa: sulfur chemistry and phytotoxicity. | Journal of chemical ecology 20040201 |
| Truffle thio-flavours reversibly inhibit truffle tyrosinase. | FEMS microbiology letters 20030314 |
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