Dl-α-Tocopherol
Properties
- Molecular formula
- C29H50O2
- Molar mass
- 430.72 g/mol
- Exact mass
- 430.3811 Da
- logP
- 8.84Crippen estimate
- Polar surface area
- 29.5 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 12
- Stereocentres
- S, S, Sin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
2074-53-5SMILES
Cc1c(C)c2c(c(C)c1O)CC[C@](C)(CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)O2InChIKey
GVJHHUAWPYXKBD-BFRPKOEANA-NInChI
InChI=1/C29H50O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h20-22,30H,9-19H2,1-8H3/t21-,22-,29-/s2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, (2R)-rel-
- 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, [2R*(4R*,8R*)]-
- Rel-(2R)-3,4-Dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran-6-ol
- NSC 82623
- (±)-2R,4′R,8′R-α-Tocopherol
- Riken E acetate 960
Work with Dl-α-Tocopherol
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
DL-α-Tocopherol acetate52225-20-467 % similar
α-Tocopheryl acetate58-95-767 % similar
Dl-alpha-tocopherol acetate7695-91-267 % similar
(+)-Gamma-Tocopherol54-28-464 % similar
Alpha-Tocopherol succinate4345-03-363 % similar
Tocofersolan9002-96-459 % similar
Dl-α-Tocopherol calcium succinate14638-18-757 % similar
Tocopherol nicotinate16676-75-855 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.