Tocopherols

Tocopherols
Compound Structure:
Synonyms: Tocopherols ;7616-22-0 ;Rac-gamma-tocopherol; (+/-)-gamma-Tocopherol ;73980-80-0
Compound ID: NMPC-1540
PubChem ID:

14986
Molecular Formula: C28H48O2
Canonical SMILES: CC1=C(C=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)O
InChIKey: QUEDXNHFTDJVIY-UHFFFAOYSA-N
About the compound:

GHS Hazard Statements

Not Classified

Reported as not meeting GHS hazard criteria by 70 of 70 companies. For more detailed information, please visit ECHA C&L website.
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

416.7 g/mol

XLogP3-AA

10.3

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

2

Rotatable Bond Count

12

Exact Mass

416.365430770 g/mol

Monoisotopic Mass

416.365430770 g/mol

Topological Polar Surface Area

29.5Ų

Heavy Atom Count

30

Formal Charge

0

Complexity

475

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

3

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Source:PubChem
Source Species: Lonchocarpus cyanescens
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