ChemicalBook--->CAS DataBase List--->7695-91-2

7695-91-2

7695-91-2 Structure

7695-91-2 Structure
IdentificationMore
[Name]

Tocopheryl acetate
[CAS]

7695-91-2
[Synonyms]

[2r-[2r*(4r*,8r*)]]-3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2h-1-benzopyran-6-ol acetate
3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-yl acetate
ALL-RAC-ALPHA-TOCOPHERYL ACETATE
(+/-)-ALPHA-TOCOPHEROL ACETATE
ALPHA-TOCOPHERYL ACETATE
ALPHA-TOCOPHERYLIS ACETAS
(+)-A-TOCOPHEROL
DL-2,5,7,8-TETRAMETHYL-2-(4,8,12-TRIMETHYLTRIDECYL)-6-CHROMANOL ACETATE
DL-ALFACOL
DL-ALPHA-TOCOPHEROL ACETATE
DL-ALPHA-TOCOPHERYL ACETATE
DL-A-TOCOPHEROL ACETATE
DL-A-TOCOPHERYL ACETATE
DL-CONTOPHERON
DL-ECON
DL-FERTILVIT
DL-TOCOPHRIN
DL-VITAMIN E ACETATE
EPSILAN-M
O-ACETYL-ALPHA-TOCOPHEROL
[EINECS(EC#)]

231-710-0
[Molecular Formula]

C31H52O3
[MDL Number]

MFCD00072042
[Molecular Weight]

472.74
[MOL File]

7695-91-2.mol
Chemical PropertiesBack Directory
[Melting point ]

-28°C
[Boiling point ]

224 °C0.3 mm Hg(lit.)
[density ]

0.96 g/mL at 20 °C(lit.)
[vapor density ]

16.3 (vs air)
[refractive index ]

n20/D 1.497
[Fp ]

>230 °F
[storage temp. ]

2-8°C
[solubility ]

Practically insoluble in water, freely soluble in acetone, in anhydrous ethanol and in fatty oils.
[form ]

neat
[color ]

Clear yellow viscous liquid
[Specific Gravity]

0.962 (20/4℃)
[Odor]

Odorless
[biological source]

synthetic (organic)
[Water Solubility ]

Immiscible with water.
[Sensitive ]

Air & Light Sensitive
[Merck ]

14,9495
[BRN ]

97512
[Major Application]

pharmaceutical (small molecule)
vitamins, nutraceuticals, and natural products
[Cosmetics Ingredients Functions]

SKIN CONDITIONING
ANTIOXIDANT
[InChI]

1S/C31H52O3/c1-21(2)13-10-14-22(3)15-11-16-23(4)17-12-19-31(9)20-18-28-26(7)29(33-27(8)32)24(5)25(6)30(28)34-31/h21-23H,10-20H2,1-9H3/t22-,23-,31-/m1/s1
[Contact allergens]

Tocopherol and tocopheryl acetate are used mainly as antioxidants. Tocopheryl acetate, an ester of tocopherol (vitamin E), can induce allergic contact dermatitis.
[InChIKey]

ZAKOWWREFLAJOT-CEFNRUSXSA-N
[SMILES]

CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCc2c(C)c(OC(C)=O)c(C)c(C)c2O1
[LogP]

12.260 (est)
[Uses]

vitamin E acetate (tocopherol acetate,7695-91-2) is an anti-oxidant with skinmoisturizing activity. given its free-radical scavenging properties, it is useful in uV protective products. Vitamin e acetate is commonly used to replace vitamin e because it is more stable and is converted to vitamin e by the body.
[CAS DataBase Reference]

7695-91-2(CAS DataBase Reference)
[NIST Chemistry Reference]

(+)-«ALPHA»-tocopherol acetate(7695-91-2)
[EPA Substance Registry System]

7695-91-2(EPA Substance)
Hazard InformationBack Directory
[Chemical Properties]

Light yellow to yellow clear liquid
[Uses]

anti-Altzheimer therapeutic
[Definition]

ChEBI:DL-alpha-Tocopherol acetate is a tocol.
[General Description]

DL-α-Tocopherol acetate is a stable ester form of vitamin E, widely used in the formulation of cosmetics for the prevention or correction of skin damage.
[Hazard]

A reproductive hazard.
[Flammability and Explosibility]

Nonflammable
[Biochem/physiol Actions]

Tocopherols are lipid soluble anti-oxidants that protect cell membranes from oxidative damage. α-Tocopherol is the form of tocopherol preferentially absorbed by Homosapiens. DL-α-Tocopherol acetate can inhibit oxidation of linoleate.
[storage]

Store at -20°C
[Purification Methods]

It is a viscous liquid which is purified by distillation under high vacuum under N2 or Ar and stored in sealed ampoules in the dark. It is considerably more stable to light and air than the parent unacetylated vitamin. It is insoluble in H2O but freely soluble in organic solvents. All eight stereoisomers have been synthesised. The commercially pure d-tocopheryl acetate (2R,4'R,8'R) has b 180-200o/0.7mm and [] D 20 +3.9o (c 5, EtOH); see above. [Cohen et al. Helv Chim Acta 64 1158 1981, Beilstein 17/4 V 169.]
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)Skull and Crossbones (GHS06)Health Hazard (GHS08)
GHS02,GHS06,GHS08
[Signal word ]

Danger
[Hazard statements ]

H413
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

1
[RTECS ]

GA8747000
[F ]

8-10-23
[Autoignition Temperature]

303°C
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29362800
[Storage Class]

10 - Combustible liquids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Dichloromethane-->Sodium chloride-->Xylene-->Zinc chloride-->Diisopropyl ether-->PASSION FLOWER OIL-->Soybean oil-->SODIUM SULFATE DECAHYDRATE-->Isophytol-->Trimethylhydroquinone-->D-α-Tocopherol-->(POLYOL)
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-yl acetate(7695-91-2).msds
Spectrum DetailBack Directory
[Spectrum Detail]

Tocopheryl acetate(7695-91-2)1HNMR
Tocopheryl acetate(7695-91-2)IR
Tocopheryl acetate(7695-91-2)Raman
Tocopheryl acetate(7695-91-2)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

Vitamin E acetate, 97%(7695-91-2)
[Sigma Aldrich]

7695-91-2(sigmaaldrich)
[TCI AMERICA]

DL-alpha-Tocopherol Acetate,>98.0%(GC)(7695-91-2)
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