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α-Tocopherol-[phenyl-5,7-dimethyl-d6]

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General Information
Catalog: BLP-000307
CAS: 113892-08-3
Molecular Formula: C29H44D6O2
Molecular Weight: 436.74

Chemical Structure

Synonyms	Vitamin E (ring-5,7-dimethyl-d6); α-Tocopherol (phenyl-5,7-dimethyl-d6)
IUPAC Name	(2R)-2,8-dimethyl-5,7-bis(trideuteriomethyl)-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol
Related CAS	59-02-9 (unlabelled)
Canonical SMILES	CC1=C(C2=C(CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C)C(=C1O)C)C
InChI	InChI=1S/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-/m1/s1/i5D3,7D3
InChI Key	GVJHHUAWPYXKBD-BCHQTGRQSA-N
Boiling Point	200-220 °C at 1 mmHg (lit.)
Purity	≥98% (CP); ≥98% atom D
Density	0.963 g/mL at 25 °C
Appearance	Yellow to Brown Liquid
Storage	Store at -20°C