AG00IABL

58-95-7 | 2H-​1-​Benzopyran-​6-​ol, 3,​4-​dihydro-​2,​5,​7,​8-​tetramethyl-​2-​[(4R,​8R)​-​4,​8,​12-​trimethyltridecyl]​-​, 6-​acetate, (2R)​-

AG00IABL

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CAS Number	58-95-7
Catalog Number	AG00IABL(AGN-PC-0SR0A7)
Chemical Name	2H-​1-​Benzopyran-​6-​ol, 3,​4-​dihydro-​2,​5,​7,​8-​tetramethyl-​2-​[(4R,​8R)​-​4,​8,​12-​trimethyltridecyl]​-​, 6-​acetate, (2R)​-
IUPAC Name	[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl] acetate
InChI	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
InChI Key	ZAKOWWREFLAJOT-CEFNRUSXSA-N
MDL Number	MFCD00072052
Molecular Formula	C31H52O3
Molecular Weight	472.7428
SMILES	Cc1c2c(c(c(c1C)OC(=O)C)C)CC[C@](O2)(CCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)C
UNII	A7E6112E4N
Synonyms	3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-ol, Acetate, Tocopherol, alpha Tocopherol, alpha Tocopherol Acetate, alpha Tocopherol Hemisuccinate, alpha Tocopherol Succinate, alpha Tocopheryl Calcium Succinate, alpha-Tocopherol, alpha-tocopherol acetate, alpha-tocopherol hemisuccinate, alpha-tocopherol succinate, alpha-Tocopheryl Calcium Succinate, d alpha Tocopherol, d alpha Tocopheryl Acetate, d-alpha Tocopherol, d-alpha-Tocopheryl Acetate, R,R,R-alpha-Tocopherol, Tocopherol Acetate, Tocopherol Succinate, Tocopherol, d-alpha, Tocopheryl Acetate, vitamin E succinate, Vitamin E acetate, alpha-Tocopherol acetate, Tocopherol acetate, Alfacol, 58-95-7, Ecofrol, Contopheron, Tofaxin, Econ, Ephynal acetate, D-alpha-tocopherol acetate, Tokoferol acetate, Tocopherex, Evipherol, Fertilvit, Tocophrin, Erevit, Gevex, Juvela, Combinal E, Tocopheryl acetate, D-ALPHA-TOCOPHERYL ACETATE, (+)-alpha-Tocopherol acetate, Epsilan-M, E-Toplex, E-Ferol, Endo E Dompe, Spondyvit, Copherol 1250, Covitol 1100, Covitol 1360, Vitamin Ealpha acetate, alpha-Tocopheryl acetate, Nanotopes, 7695-91-2, Simmyungsaengmosu, NatAc, Tinoderm E, DL-alpha-Tocopheryl acetate, Vitamin E acetate, d-, Natur-E granulate, DL-alpha tocopheryl acetate, Lutavit E 50, (+)-alpha-Tocopheryl acetate, UNII-A7E6112E4N, CCRIS 4389, (+-)-alpha-Tocopherol acetate, DL-alpha-Tocopherol acetate, alpha-Tocopherol acetate, all rac, (R,R,R)-alpha-Tocopheryl acetate, .alpha.-Tocopherol acetate, C31H52O3, EINECS 200-405-4, EINECS 231-710-0, MFCD00072042, MFCD00072052, Ephynal, D-.alpha.-Tocopherol acetate, Tocopheryl acetate, D-alpha-, Vitamin E Acetate (D-form), UNII-9E8X80D2L0, Vectan (TN), BRN 0097512, CCRIS 6054, (2R,4'R,8'R)-alpha-Tocopheryl acetate, CHEBI:32321, Copherol 12250, d-|ATocopheryl Acetate, ZAKOWWREFLAJOT-CEFNRUSXSA-N, A7E6112E4N, alpha-Tocopherol acetate, (2R,4'R,8'R)-, O-Acetyl-|A-tocopherol, alpha-Tocopherylis acetas, AC1L3BMH, Tocopherolacetate, alpha-, EINECS 257-757-7, O-Acetyl-alpha-tocopherol, DL-|A-Tocopheryl acetate, DL-alpha-Tocopherylacetate, Tocopherol acetate [JAN], DSSTox_CID_1356, .alpha.-Tocopheryl acetate, AC1Q1PB2, DSSTox_RID_76104, DSSTox_RID_78863, Tocopherol acetate (JP17), (+)-|A-Tocopherol acetate, CHEMBL1047, DSSTox_GSID_21356, DSSTox_GSID_31096, NCGC00166253-02, SCHEMBL22298, (+)-|A-Tocopheryl Acetate, all-rac-|A-Tocopheryl acetate, MLS001335985, MLS001335986, (+)-.alpha.-Tocopherol acetate, (+)-.alpha.-Tocopheryl acetate, (R,R,R)-|A-Tocopheryl Acetate, D-alpha-Tocopheryl acetate, 97%, EC 231-710-0, T-3376, 9E8X80D2L0, HMS2230C20, DL-alpha-Tocopheryl acetate, 98%, Vitamin E Acetate Oil - Synthetic, 5-17-04-00169 (Beilstein Handbook Reference), Tox21_111491, Tox21_111564, Tox21_113467, Tox21_303444, ZINC4172337, 2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-6-cromanyl acetate, (+)-, 6-Cromanol, 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, (+)-, LS-245, (R,R,R)-.alpha.-Tocopheryl acetate, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-yl acetate, 6-Chromanol, 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, (+)-, AKOS025117621, Tox21_113467_1, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, (2R-(2*(4R*,8R*)))-, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, [2R-[2R*(4R*,8R*)]]-, 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl acetate, (2R-(2*(4R*,8R*)))-, 52225-20-4, CAS-58-95-7, (+-)-alpha-Tocopherol Acetateacid ester, NCGC00095255-08, NCGC00166253-01, NCGC00257504-01, (2R,4'R,8'R)-|A-Tocopherol Acetate, (2R,4'R,8'R)-|A-Tocopheryl Acetate, AK176402, AS-13784, LS-39402, LS-53371, SC-16401, SC-18242, SMR000857327, CAS-52225-20-4, (2R,4'R,8'R)-.alpha.-Tocopheryl acetate, FT-0624407, DL-|A-Tocopherol acetate, DL-alpha-Tocopherol acetate, >=96% (HPLC), DL-alpha-Tocopherol acetate, 50% powder form, 6-Chromanol, 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, C13202, D01735, DL-alpha-Tocopherylacetate (Vitamin E acetate), J10308, DL-alpha-Tocopherol acetate, analytical standard, DL-alpha-Tocopherol acetate, EP/USP/FCC grade, [(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]chroman-6-yl] acetate, 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-b- enzopyran-6-ol, acetate, [(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl] acetate, [2R*(4R*,8R*)]-()-3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-yl acetate, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-((4R,8R)-4,8,12-trimethyltridecyl)-, acetate, (2R)-, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-((4R,8R)-4,8,12-trimethyltridecyl)-, acetate, (2R)-rel-, 54-22-8, Q-201933, vitamin E acetate, (2R-(2R*(4R*,8R*)))-isomer, W-109259, ECA8C22F-B5D3-4B88-A9B7-AF6C600001BB, vitamin E acetate, ((2R*(4R*,8R*))-(+-))-isomer, DL-alpha-Tocopherol acetate, tested according to Ph.Eur., UNII-WR1WPI7EW8 component ZAKOWWREFLAJOT-CEFNRUSXSA-N, (+)-alpha-Tocopherol acetate, oil or semi-solid, ~1360 IU/g, semisynthetic, 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-6-chromanol acetate, Alpha Tocopheryl Acetate, United States Pharmacopeia (USP) Reference Standard, alpha-Tocopherol acetate, European Pharmacopoeia (EP) Reference Standard, DL-alpha-Tocopherol acetate, certified reference material, TraceCERT(R), (+)-alpha-Tocopherol acetate, BioReagent, suitable for insect cell culture, ~1360 IU/g, 2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl acetate #, Tocopheryl Acetate, a, Pharmaceutical Secondary Standard; Certified Reference Material, (2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-yl acetate, (2R)-3,4-Dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran-6-ol 6-Acetate, (2R*(4R*,8R*))-(1)-3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-yl acetate, [2R-[2R*(4R,8R*)]]-3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-ol acetate, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-((4R,8R)-4,8,12-trimethyltridecyl)-, 6-acetate, (2R)-, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, 6-acetate, 2H-1-benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate,, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate,(2R*(4R*,8R*))-(+-)-, 2H-1-Benzopyran-6-ol,3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-,6-acetate, (2R)-, all-rac-2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-yl acetate, All-rac-alpha-tocopheryl acetate for peak identification, European Pharmacopoeia (EP) Reference Standard, vitamin-e-acetate, 1406-70-8, MolPort-003-928-528, 12741-00-3, 133-80-2, 1407-18-7, 26243-95-8, Eusovit, E-vicotrat, Syntopherol acetate, OptoVit E, SynAC, E-Vimin, Infuvite Pediatric, Rovimix E 50SD, Tocopherol, acetate, d-Vitamin E acetate, alpha-tocopherylacetat, Rovimix E 50, TCPA, VITAMINEACETATE, ?-Tocopherol acetate, dl-Vitamin E acetate, a- tocopheryl acetate, |A-Tocopherol Acetate, |A-Tocopherylis acetas, Vitamin E acetate dl-form, D-?-Tocopherol acetate, alpha-tochopheryl acetate, UNII-WR1WPI7EW8, d,l-alpha-Tocopheryl acetate, all-rac-alpha-Tocopheryl acetate, Alpha-tocopherol acetate, dl-, MULTI-12, D-.alpha.-Tocopheryl acetate, Vitamin E acetate, 97% 25g, .alpha.-tocopherol acetate, dl-, DL-ALPHA-TOCOPHEROLACETATE, CID86472, C31-H52-O3, CS-O-00415, .ALPHA.-TOCOPHEROL ACETATE, D-, NCGC00095254-04, NCGC00142625-03, N020, D-alpha-Tocopherol acetate, 98% - 1G 1g, T2322, DL-?-Tocopherol Acetate 96% for biochemistry 50gm, 2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl acetate, [2R*(4R*,8R*)]-(+-)-3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-yl acetate, 2H-1-Benzopiran-6-ol, 3,4-dihidro-2,5,7,8-tetrametil-2-[(4R,8R)-4,8,12-trimetiltridecil]-, 6-acetato, (2R)-rel-, 2H-1-benzopirano-6-ol, 3,4-dihidro-2,5,7,8-tetrametil-2-[(4R, 8R)-4,8,12-trimetiltridecil]-, 6-acetato, ( 2R)-, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl- 2-(4,8,12-trimethyltridecyl)-, acetate, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl- 2-(4,8,12-trimethyltridecyl)-, acetate, [2R-[2R(4R,8R)]]-, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, (2R-(2R*(4R*,8R*)))-, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, [2R*(4R*,8R*)]-, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, [2R*(4R*,8R*)]-(.+.)-, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, acetate, (2R)-, 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, acetate, (2R)-rel-, 3, 4- dihydro- 2, 5, 7, 8- tetramethyl- 2- (4, 8, 12- trimethyltridecyl)- 2H- benzopyran- 6- yl acetate,

Complexity	602
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	472.392g/mol
Formal Charge	0
Heavy Atom Count	34
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	472.754g/mol
Monoisotopic Mass	472.392g/mol
Rotatable Bond Count	14
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	10.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H413
Packing Group	Ⅲ
Precautionary statements	P273
UN Code	UN 3077

Certificate of Analysis

Lot Number