3-Methyl-1-hexyn-3-ol

CAS Registry Number®

4339-05-3
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CAS Name

3-Methyl-1-hexyn-3-ol

Molecular Formula

C7H12O

Molecular Mass

112.17

Cite this Page

3-Methyl-1-hexyn-3-ol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=4339-05-3 (retrieved 2024-04-27) (CAS RN: 4339-05-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    137 °C

  • Density (2)

    0.8671 g/cm³ @ Temp: 17 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H12O/c1-4-6-7(3,8)5-2/h2,8H,4,6H2,1,3H3

InChIKey

InChIKey=DTGUZRPEDLHAAO-UHFFFAOYSA-N

SMILES

C(CCC)(C#C)(C)O

Canonical SMILES

C#CC(O)(C)CCC

Other Names for this Substance

  • 1-Hexyn-3-ol, 3-methyl-
  • 3-Methyl-1-hexyn-3-ol
  • Ethynylmethylpropylcarbinol
  • NSC 9470
  • 3-Propyl-1-butyn-3-ol

Deleted or Replaced CAS Registry Numbers

104684-17-5

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