3-{[(methylthio)carbonyl]amino}adamantane-1-carboxylic acid
Weight269.366 g/mol
FormulaC13H19NO3S
Hydrogen Acceptors3
Hydrogen Donors2
Aromatic Rings0
Rotatable Bonds2

3-{[(methylthio)carbonyl]amino}adamantane-1-carboxylic acid (342046-29-1)

342046-29-1

Suppliers

Alternate Names

  • 342046-29-1
  • SMILES
    CSC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)O
  • InChIKey
    CFJDXKRKCMCKOD-UHFFFAOYSA-N

Estimated Properties

Boiling Point 444.9 C EPI Suite
Density 1.3 g/cm3 EPA T.E.S.T.
Flash Point 229.55 C EPA T.E.S.T.
Melting Point 186.86 C EPI Suite
Water Solubility 453.96 mg/L EPA T.E.S.T.
Water Solubility 1464.8 mg/L EPI Suite

External Links

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