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CAS 134-53-2

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Benzeneacetic acid, α-(hydroxymethyl)-, 3-(diethylamino)-2,2-dimethylpropyl ester, phosphate (1:1) (salt)

Description:
Benzeneacetic acid, α-(hydroxymethyl)-, 3-(diethylamino)-2,2-dimethylpropyl ester, phosphate (1:1) (salt), commonly referred to by its CAS number 134-53-2, is a chemical compound characterized by its complex structure, which includes a benzene ring, an acetic acid moiety, and a phosphate group. This compound typically exhibits properties associated with both organic and inorganic substances, including solubility in polar solvents due to the presence of the phosphate group. It is often utilized in pharmaceutical applications, particularly as a drug delivery agent or in the synthesis of biologically active compounds. The presence of the diethylamino group suggests potential basicity, which may influence its interaction with biological systems. Additionally, the ester functionality indicates that it may undergo hydrolysis under certain conditions, releasing the corresponding acid and alcohol. Overall, this compound's unique structural features contribute to its reactivity and potential applications in medicinal chemistry and biochemistry.
Formula:C18H29NO3·H3O4P
InChI:InChI=1S/C18H29NO3.H3O4P/c1-5-19(6-2)13-18(3,4)14-22-17(21)16(12-20)15-10-8-7-9-11-15;1-5(2,3)4/h7-11,16,20H,5-6,12-14H2,1-4H3;(H3,1,2,3,4)
InChI key:InChIKey=YHASIXBUOZWGHL-UHFFFAOYSA-N
SMILES:P(=O)(O)(O)O.C(C(OCC(CN(CC)CC)(C)C)=O)(CO)C1=CC=CC=C1
Synonyms:
  • Amprotropine phosphate
  • Tropic acid, 3-(diethylamino)-2,2-dimethylpropyl ester, phosphate
  • Tropic acid, 3-(diethylamino)-2,2-dimethylpropyl ester, phosphate (1:1)
  • 1-Propanol, 3-(diethylamino)-2,2-dimethyl-, tropate, phosphate
  • Benzeneacetic acid, α-(hydroxymethyl)-, 3-(diethylamino)-2,2-dimethylpropyl ester, phosphate (1:1) (salt)
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