Tocol

CAS Registry Number®

119-98-2

CAS Name

Tocol

Molecular Formula

C26H44O2

Molecular Mass

388.63

Cite this Page

Tocol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=119-98-2 (retrieved 2024-11-25) (CAS RN: 119-98-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    170 °C

  • Melting Point (1)

    <25 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C26H44O2/c1-20(2)9-6-10-21(3)11-7-12-22(4)13-8-17-26(5)18-16-23-19-24(27)14-15-25(23)28-26/h14-15,19-22,27H,6-13,16-18H2,1-5H3

InChIKey

InChIKey=DFUSDJMZWQVQSF-UHFFFAOYSA-N

SMILES

C(CCC(CCCC(CCCC(C)C)C)C)C1(C)OC=2C(CC1)=CC(O)=CC2

Canonical SMILES

OC1=CC=C2OC(C)(CCC2=C1)CCCC(C)CCCC(C)CCCC(C)C

Other Names for this Substance

  • 2H-1-Benzopyran-6-ol, 3,4-dihydro-2-methyl-2-(4,8,12-trimethyltridecyl)-
  • 6-Chromanol, 2-methyl-2-(4,8,12-trimethyltridecyl)-
  • Tocol
  • 3,4-Dihydro-2-methyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-ol
  • 6-Hydroxy-2-methyl-2-phytylchroman

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