Tonalide

CAS Registry Number®

21145-77-7

CAS Name

Tonalide

Molecular Formula

C18H26O

Molecular Mass

258.40

Cite this Page

Tonalide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=21145-77-7 (retrieved 2024-11-23) (CAS RN: 21145-77-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    124 °C @ Press: 1 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H26O/c1-11-8-16-15(9-14(11)13(3)19)17(4,5)10-12(2)18(16,6)7/h8-9,12H,10H2,1-7H3

InChIKey

InChIKey=DNRJTBAOUJJKDY-UHFFFAOYSA-N

SMILES

CC1(C)C=2C(=CC(C(C)=O)=C(C)C2)C(C)(C)CC1C

Canonical SMILES

O=C(C=1C=C2C(=CC1C)C(C)(C)C(C)CC2(C)C)C

Other Names for this Substance

  • Ethanone, 1-(5,6,7,8-tetrahydro-3,5,5,6,8,8-hexamethyl-2-naphthalenyl)-
  • 2′-Acetonaphthone, 5′,6′,7′,8′-tetrahydro-3′,5′,5′,6′,8′,8′-hexamethyl-
  • 1-(5,6,7,8-Tetrahydro-3,5,5,6,8,8-hexamethyl-2-naphthalenyl)ethanone
  • Tonalid
  • Tonalide

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Deleted or Replaced CAS Registry Numbers

131433-13-1

CAS INSIGHTSTM
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