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CAS 90940-45-7

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2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, 6-(dihydrogen phosphate), sodium salt (1:2), (2R)-

Description:
The chemical substance known as 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, 6-(dihydrogen phosphate), sodium salt (1:2), (2R)-, with CAS number 90940-45-7, is a complex organic compound characterized by its unique structure that includes a benzopyran moiety and a phosphate group. This compound is typically soluble in water due to the presence of the sodium salt form, which enhances its hydrophilicity. It exhibits properties associated with both phenolic compounds and phosphates, potentially contributing to its biological activity. The presence of multiple methyl groups in its structure suggests that it may have a significant impact on its physical properties, such as melting point and volatility. Additionally, the stereochemistry indicated by the (2R) and (4R,8R) designations suggests specific spatial arrangements that could influence its reactivity and interactions with biological systems. Overall, this compound may have applications in fields such as biochemistry, pharmaceuticals, or as a functional ingredient in various formulations.
Formula:C29H52NaO5P
InChI:InChI=1S/C29H51O5P.2Na/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(34-35(30,31)32)23(5)24(6)28(26)33-29;;/h20-22H,9-19H2,1-8H3,(H2,30,31,32);;/t21-,22-,29-;;/m1../s1
InChI key:InChIKey=YPYJTBBUUUHPNE-RQGAJXLPSA-N
SMILES:CC1=C2C(=C(C)C(OP(=O)(O)O)=C1C)CC[C@](CCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)(C)O2.[Na]
Synonyms:
  • Disodium dihydrogen phosphate (2R(2R*(4R*,8R*)))-3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-benzopyran-6-olate
  • Disodium α-tocopheryl phosphate
  • 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, dihydrogen phosphate, disodium salt, [2R-[2R*(4R*,8R*)]]-
  • α-Tocopherol phosphate, disodium salt
  • 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, 6-(dihydrogen phosphate), sodium salt (1:2), (2R)-
  • (R)-2,5,7,8-Tetramethyl-2-((4R,8R)-4,8,12-trimethyltridecyl)chroman-6-yl dihydrogen phosphate, disodium salt
  • Phosphoric acid disodium[(R)-3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran]-6-yl ester salt
  • LPWACMVJQSCQOF-RQGAJXLPSA-L
  • (2R)-3,4-Dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran-6-ol (phosphoric acid disodium) salt
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