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tert-Butyl azepan-3-ylcarbamate
Weight214.309 g/mol
FormulaC11H22N2O2
Hydrogen Acceptors3
Hydrogen Donors2
Aromatic Rings0
Rotatable Bonds1

tert-Butyl azepan-3-ylcarbamate (454451-26-4)

tert-butyl 3-azepanylcarbamate  ·  454451-26-4

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Alternate Names

  • tert-butyl 3-azepanylcarbamate
  • 454451-26-4
  • SMILES
    CC(C)(C)OC(=O)NC1CCCCNC1
  • InChIKey
    NZEPWAXJSWYEDV-UHFFFAOYSA-N

Estimated Properties

Boiling Point 284.47 C EPA T.E.S.T.
Boiling Point 296.79 C EPI Suite
Density 1.03 g/cm3 EPA T.E.S.T.
Flash Point 138.16 C EPA T.E.S.T.
Melting Point 81.44 C EPI Suite
Water Solubility 2807.15 mg/L EPA T.E.S.T.
Water Solubility 111410 mg/L EPI Suite

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Synthesis

(R)-Azepan-3-amine  +  Di-tert-butyl dicarbonate (Amine protection with Boc)
Reactant  +  (R)-Azepan-3-amine (Schotten-Baumann amide from acyl chloride)
tert-Butyl carbamate  +  Reactant (Alkylation of primary amines)
Reactant  +  2-Chloro-2-methylpropane (Ester from carboxilic acid(SN2))
Synthesis of tert-Butyl azepan-3-ylcarbamate ›

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