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Screening compounds

Tocol

Also known as Desmethyltocopherol, 2-Methyl-2-phytyl-6-chromanol, 2-Methyl-2-phytyl-6-hydroxychroman

CAS 119-98-2Formula C26H44O2Molar mass 388.64 g/mol
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Tocol chemical structure, C26H44O2, CAS 119-98-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
119-98-2
Formula
C26H44O2
Molar mass
388.64 g/mol
HS code
293299
Category
Screening compounds

What is Tocol?

Plain description, key identifiers and synonyms

Tocol is a chemical substance with the molecular formula C26H44O2 and a molar mass of 388.64 g/mol. Its CAS registry number is 119-98-2. The IUPAC name is 2-methyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
2-methyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol
CAS number
119-98-2 CAS number cross-checked
Molecular formula
C26H44O2
UNII
S2XEE7OB8X
MDL number
MFCD08703020
InChIKey
DFUSDJMZWQVQSF-UHFFFAOYSA-N
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
SMILES (canonical and isomeric)
CC(C)CCCC(C)CCCC(C)CCCC1(CCC2=C(O1)C=CC(=C2)O)C

Synonyms

  • Desmethyltocopherol
  • 2-Methyl-2-phytyl-6-chromanol
  • 2-Methyl-2-phytyl-6-hydroxychroman
  • 6-Hydroxy-2-methyl-2-phytylchroman
  • 2-Methyl-2-(4,8,12-trimethyltridecyl)-6-chromanol
  • 2H-1-Benzopyran-6-ol, 3,4-dihydro-2-methyl-2-(4,8,12-trimethyltridecyl)-
  • (+/-)-Tocol
  • 2-methyl-2-(4,8,12-trimethyltridecyl)chroman-6-ol
  • (?)-Tocol
  • 3,4-Dihydro-2-methyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-ol
  • 2-methyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol
  • 2-Methyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-ol
  • Vitamin E Related Compound 1 (2-Methyl-2-(4,8,12-Trimethyltridecyl)-6-Chromanol)

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
388.64 g/molcalc.
Exact mass
388.3341 Dacalc.
LogP (octanol/water)
7.92calc.
Topological polar surface area
29.46 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
12calc.
Heavy atoms
28calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.77calc.
Formal charge
0calc.
Stereocentres
3calc.
Lipinski rule of five
Passes (1 violation)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, c1ccc2c(c1)CCCO2

c1ccc2c(c1)CCCO2

2 rings, 10 atoms, the Chroman ring system.

4,102 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Tocol suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

No supplier listings yet

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Tocol price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

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Uses and applications

What the substance is used for, by industry and function

Roles

  • antioxidant

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Tocol is traded under.

HS 2932.99Indicative HS code

Heterocyclic compounds with oxygen hetero-atom(s) only, other

World exports in 2024
$3.81B
+10.3% vs 2023, imports $7.05B
2019 to 2024
Top exporters
  1. China28.9%
  2. Switzerland * partner reported12.7%
  3. Germany7.8%
Top importers
  1. United States49.7%
  2. China11.9%
  3. India * partner reported3.3%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Tocol is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Tocol, based on the data on this page

What is Tocol?

Tocol is a chemical substance with the molecular formula C26H44O2 and a molar mass of 388.64 g/mol. Its CAS registry number is 119-98-2. The IUPAC name is 2-methyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol.

What is the CAS number of Tocol?

The CAS registry number of Tocol is 119-98-2.

What is the molecular formula and weight of Tocol?

The molecular formula of Tocol is C26H44O2 and its molar mass is 388.64 g/mol.

What is Tocol used for?

Known uses and roles of Tocol include building blocks in research and laboratory, screening compounds in research and laboratory and antioxidant.

Is Tocol hazardous?

No GHS hazard classification for Tocol is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Tocol?

Tocol is usually classified under HS code 293299 (Heterocyclic compounds with oxygen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Tocol?

Post a free request on CompoundList and suppliers of Tocol will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Tocol?

Suppliers quote Tocol on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Tocol

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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