chempirical

2,4-Dithiapentane

C3H8S2CAS 1618-26-4108.22 g/mol

Open in Covalent MOL file
SS
Sulfide

Properties

Molecular formula
C3H8S2
Molar mass
108.22 g/mol
Exact mass
108.0067 Da
Density
1.0594 g/mL (at 20 °C)
Melting point
148 °C
Boiling point
148 °C
logP
1.67Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Identifiers

CAS number
1618-26-4
SMILES
CSCSC
InChIKey
LOCDPORVFVOGCR-UHFFFAOYSA-N
InChI
InChI=1S/C3H8S2/c1-4-3-5-2/h3H2,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

8 names
  • Methane, bis(methylthio)-
  • Bis(methylthio)methane
  • Formaldehyde dimethyl mercaptal
  • Thioformaldehyde dimethyl acetal
  • Bis[methylmercapto]methane
  • Methylenebis[methyl sulfide]
  • Formaldehyde dimethyl dithioacetal
  • NSC 96010

Work with 2,4-Dithiapentane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethyl methyl sulfide624-89-543 % similar Chloromethyl methyl sulfide2373-51-540 % similar Methyl propyl sulfide3877-15-438 % similar 2-Methylthioethylamine18542-42-235 % similar 2-Chloroethyl methyl sulfide542-81-435 % similar Allyl methyl sulfide10152-76-833 % similar (Methylthio)acetaldehyde23328-62-333 % similar 2-(Methylthio)acetonitrile35120-10-633 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Propane-1,3-dithiol109-80-8 1,2-Propanedithiol814-67-5

Elsewhere

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