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CAS 71607-32-4

:

Butanedioic acid, 2,3-bis[(4-methylbenzoyl)oxy]-, hydrate (1:1), (2R,3R)-

Description:
Butanedioic acid, 2,3-bis[(4-methylbenzoyl)oxy]-, hydrate (1:1), (2R,3R)-, with CAS number 71607-32-4, is a chemical compound characterized by its structure, which includes a butanedioic acid backbone modified with two 4-methylbenzoyl ether groups. This compound is typically a white to off-white solid and is soluble in organic solvents, reflecting its hydrophobic aromatic components. The presence of the hydroxyl groups in the butanedioic acid moiety contributes to its potential for hydrogen bonding, which may influence its solubility and reactivity. The (2R,3R) stereochemistry indicates specific spatial arrangements of the substituents, which can affect the compound's biological activity and interactions. As a hydrate, it contains water molecules in its crystalline structure, which can impact its stability and handling. This compound may be of interest in various applications, including pharmaceuticals and materials science, due to its unique chemical properties and potential reactivity.
Formula:C20H18O8·H2O
InChI:InChI=1S/C20H18O8.H2O/c1-11-3-7-13(8-4-11)19(25)27-15(17(21)22)16(18(23)24)28-20(26)14-9-5-12(2)6-10-14;/h3-10,15-16H,1-2H3,(H,21,22)(H,23,24);1H2/t15-,16-;/m1./s1
InChI key:InChIKey=FOTRUJUPLHRVNU-QNBGGDODSA-N
SMILES:[C@H]([C@@H](OC(=O)C1=CC=C(C)C=C1)C(O)=O)(OC(=O)C2=CC=C(C)C=C2)C(O)=O.O
Synonyms:
  • (-)-Di-p-toluoyl-L-tartaric acid monohydrate
  • (2S,3S)-2,3-bis{[(4-methylphenyl)carbonyl]oxy}butanedioic acid hydrate
  • Butanedioic acid, 2,3-bis[(4-methylbenzoyl)oxy]-, hydrate (1:1), (2R,3R)-
  • Butanedioic acid, 2,3-bis[(4-methylbenzoyl)oxy]-, monohydrate, (2R,3R)-
  • Butanedioic acid, 2,3-bis[(4-methylbenzoyl)oxy]-, monohydrate, [R-(R*,R*)]-
  • Butanedioic acid, 2,3-dihydroxy-2,3-bis(4-methylbenzoyl)-, hydrate (1:1)
  • D(+)-O,O'-di(p-toluoyl)tartaric acid Monohydrate
  • D-Dtta(H2O)
  • Di-p-methylbenzoyl-D-tartaric acid,monohydrate
  • L-Dtta(H2O)
  • (+)-Di-p-toluoyl-D-tartaric acid monohydrate
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