chempirical

Diethyl thiodiglycolate

C8H14O4SCAS 925-47-3206.26 g/mol

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EsterSulfide

Properties

Molecular formula
C8H14O4S
Molar mass
206.26 g/mol
Exact mass
206.0613 Da
Boiling point
155–160 °C
logP
0.85Crippen estimate
Polar surface area
52.6 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
6

Identifiers

CAS number
925-47-3
SMILES
CCOC(=O)CSCC(=O)OCC
InChIKey
TVCSSJHLVLMADJ-UHFFFAOYSA-N
InChI
InChI=1S/C8H14O4S/c1-3-11-7(9)5-13-6-8(10)12-4-2/h3-6H2,1-2H3

Weigh it out

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

Names and synonyms

7 names
  • Acetic acid, 2,2′-thiobis-, 1,1′-diethyl ester
  • Acetic acid, thiodi-, diethyl ester
  • Acetic acid, 2,2′-thiobis-, diethyl ester
  • Bis(carbethoxymethyl) sulfide
  • Diethyl thiodiacetate
  • Diethyl 2,2′-thiodiacetate
  • NSC 12576

Work with Diethyl thiodiglycolate

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 (methylthio)acetate4455-13-468 % similar Diethyl malonate105-53-361 % similar Ethyl propionate105-37-358 % similar Diethyl glutarate818-38-258 % similar Ethyl bromoacetate105-36-254 % similar Ethyl chloroacetate105-39-554 % similar Diethyl 1,3-acetonedicarboxylate105-50-054 % similar Ethyl butyrate105-54-454 % similar

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

Same formula

Dimethyl 3,3′-thiodipropionate4131-74-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook