Cyclohexyl isocyanate

CAS Registry Number®

3173-53-3
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CAS Name

Cyclohexyl isocyanate

Molecular Formula

C7H11NO

Molecular Mass

125.17

Cite this Page

Cyclohexyl isocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=3173-53-3 (retrieved 2024-04-28) (CAS RN: 3173-53-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    168 °C
  • Melting Point (2)

    -80 °C
  • Density (1)

    0.98 g/cm³

Source(s)

  • (1) International Chemical Safety Cards data were obtained from the National Institute for Occupational Safety and Health (US)
  • (2) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C7H11NO/c9-6-8-7-4-2-1-3-5-7/h7H,1-5H2

InChIKey

InChIKey=KQWGXHWJMSMDJJ-UHFFFAOYSA-N

SMILES

N(=C=O)C1CCCCC1

Canonical SMILES

O=C=NC1CCCCC1

Other Names for this Substance

  • Cyclohexane, isocyanato-
  • Isocyanic acid, cyclohexyl ester
  • Isocyanatocyclohexane
  • Cyclohexyl isocyanate
  • NSC 87419

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