3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-yl dihydrogen phosphate

Base Information

• Chemical Name: 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-yl dihydrogen phosphate
• CAS No.: 2312-88-1
• Molecular Formula: C₂₉H₅₁O₅P
• Molecular Weight: 510.695
• European Community (EC) Number: 219-008-2
• DSSTox Substance ID: DTXSID30945798
• Nikkaji Number: J213.188I
• Mol file: 2312-88-1.mol

Synonyms:2312-88-1;alpha-Tocopherol phosphate, DL-;EINECS 219-008-2;3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-yl dihydrogen phosphate;UNII-P7Q15MLX1X;C29H51O5P;C29-H51-O5-P;SCHEMBL15960056;DTXSID30945798;AKOS030260352;2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-yl dihydrogen phosphate

Chemical Property of 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-yl dihydrogen phosphate

Chemical Property:

• Vapor Pressure: 5.35E-16mmHg at 25°C
• Boiling Point: 615.3°Cat760mmHg
• Flash Point: 325.9°C
• PSA: 85.80000
• Density: 1.04g/cm³
• LogP: 8.60610
• XLogP3: 9.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 14
• Exact Mass: 510.34741172
• Heavy Atom Count: 35
• Complexity: 664

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=C(C2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)OP(=O)(O)O)C

Technology Process of 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-yl dihydrogen phosphate

There total 3 articles about 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-yl dihydrogen phosphate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 70.0%

P,P'-Bis-(DL-α-tocopheryl) diphosphate (87291-72-3) → DL-α-Tocopheryl phosphate (2312-88-1,38976-17-9,71276-50-1)

Guidance literature:

With hydrogenchloride; In tetrahydrofuran; for 3h; Heating;

DOI:10.1007/BF00765776

Reference yield:

→ dl-α-tocopheryl phospate (38976-17-9,71276-50-1,2312-88-1)

Guidance literature:

5, Pyridin/W.;

Reference yield:

DL-α-Tocopheryl phosphate dianilide (87291-70-1) → DL-α-Tocopheryl phosphate (2312-88-1,38976-17-9,71276-50-1)

Guidance literature:

With isopentyl nitrite; In pyridine; acetic acid; for 20h; Yield given;

DOI:10.1007/BF00765776

upstream raw materials:

DL-α-Tocopheryl phosphate dianilide

P,P'-Bis-(DL-α-tocopheryl) diphosphate

Refernces