η-Tocopherol

CAS Registry Number®

91-86-1
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CAS Name

η-Tocopherol

Molecular Formula

C27H46O2

Molecular Mass

402.65

Cite this Page

η-Tocopherol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=91-86-1 (retrieved 2024-07-05) (CAS RN: 91-86-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • 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/C27H46O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)23(5)18-26(24)29-27/h18-22,28H,7-17H2,1-6H3

InChIKey

InChIKey=PZZKGQBMBVYPGR-UHFFFAOYSA-N

SMILES

C(CCC(CCCC(CCCC(C)C)C)C)C1(C)OC=2C(CC1)=CC(O)=C(C)C2

Canonical SMILES

OC=1C=C2C(OC(C)(CC2)CCCC(C)CCCC(C)CCCC(C)C)=CC1C

Other Names for this Substance

  • 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,7-dimethyl-2-(4,8,12-trimethyltridecyl)-
  • 6-Chromanol, 2,7-dimethyl-2-(4,8,12-trimethyltridecyl)-
  • η-Tocopherol
  • 3,4-Dihydro-2,7-dimethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-ol
  • 7-Methyltocol