Hexyl isocyanate

CAS Registry Number®

2525-62-4

CAS Name

Hexyl isocyanate

Molecular Formula

C7H13NO

Molecular Mass

127.18

Cite this Page

Hexyl isocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2525-62-4 (retrieved 2024-11-22) (CAS RN: 2525-62-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    162.5-164 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H13NO/c1-2-3-4-5-6-8-7-9/h2-6H2,1H3

InChIKey

InChIKey=ANJPRQPHZGHVQB-UHFFFAOYSA-N

SMILES

C(CCCC)CN=C=O

Canonical SMILES

O=C=NCCCCCC

Other Names for this Substance

  • Hexane, 1-isocyanato-
  • Isocyanic acid, hexyl ester
  • 1-Isocyanatohexane
  • Hexyl isocyanate
  • 1-Hexyl isocyanate

View All

Deleted or Replaced CAS Registry Numbers

409316-51-4