β-Tocotrienol

CAS Registry Number®

490-23-3
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CAS Name

β-Tocotrienol

Molecular Formula

C28H42O2

Molecular Mass

410.63

Cite this Page

β-Tocotrienol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=490-23-3 (retrieved 2024-04-19) (CAS RN: 490-23-3).  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/C28H42O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-24(6)26(29)19-23(5)27(25)30-28/h11,13,15,19,29H,8-10,12,14,16-18H2,1-7H3/b21-13+,22-15+/t28-/m1/s1

InChIKey

InChIKey=FGYKUFVNYVMTAM-WAZJVIJMSA-N

SMILES

CC1=C2C(CC[C@](CC/C=C(/CC/C=C(/CCC=C(C)C)\C)\C)(C)O2)=C(C)C(O)=C1

Canonical SMILES

OC=1C=C(C=2OC(C)(CCC=C(C)CCC=C(C)CCC=C(C)C)CCC2C1C)C

Other Names for this Substance

  • 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyl-3,7,11-tridecatrien-1-yl]-, (2R)-
  • 6-Chromanol, 2,5,8-trimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-
  • 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,8-trimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-, [R-(E,E)]-
  • 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyl-3,7,11-tridecatrienyl]-, (2R)-
  • (2R)-3,4-Dihydro-2,5,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyl-3,7,11-tridecatrien-1-yl]-2H-1-benzopyran-6-ol

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Deleted or Replaced CAS Registry Numbers

134931-97-8, 14101-69-0

CAS INSIGHTSTM
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