Isotope Science / Alfa Chemistry
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Vitamin E (Alpha-tocopherol) (5-Methyl-D3,7-methyl-D3)

Catalog Number ACM113892083
CAS 113892-08-3
Synonyms α-Tocopherol-[D6]; Vitamin E-[D6]
IUPAC Name (2R)-2,8-dimethyl-5,7-bis(trideuteriomethyl)-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol
Molecular Weight 436.74
Molecular Formula C29H44D6O2
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 (392-428 °F) at 0.1 hPa (0.1 mmHg) (lit.)
Flash Point 110 °C (230 °F)-closed cup
Purity 98%
Density 0.95 g/mL at 25 °C (77 °F)
Isomeric SMILES [2H]C([2H])([2H])C1=C(C2=C(CC[C@@](O2)(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(=C1O)C([2H])([2H])[2H])C
Isotopic Enrichment 98 atom % D
Stability Stable if stored under recommended conditions.
Unlabeled CAS 59-02-9
Unlabeled Synonyms 5,7,8-Trimethyltocol; 2,5,7,8-Tetramethyl-2-(4',8',12'-trimethyltridecyl)-6-chromanol; D-αTocopherol
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