3-Chloro-3-methyl-1-butyne

CAS Registry Number®

1111-97-3

CAS Name

3-Chloro-3-methyl-1-butyne

Molecular Formula

C5H7Cl

Molecular Mass

102.56

Cite this Page

3-Chloro-3-methyl-1-butyne.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1111-97-3 (retrieved 2024-12-01) (CAS RN: 1111-97-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    76 °C
  • Melting Point (1)

    -61 °C
  • Density (2)

    0.013 g/cm³ @ Temp: 18 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C5H7Cl/c1-4-5(2,3)6/h1H,2-3H3

InChIKey

InChIKey=QSILYWCNPOLKPN-UHFFFAOYSA-N

SMILES

C(C#C)(C)(C)Cl

Canonical SMILES

ClC(C#C)(C)C

Other Names for this Substance

  • 1-Butyne, 3-chloro-3-methyl-
  • 3-Chloro-3-methyl-1-butyne
  • 3-Methyl-3-chloro-1-butyne
  • 2-Chloro-2-methyl-3-butyne
  • 2-Methyl-2-chloro-3-butyne

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