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Ethyl 3-hydroxy-2-(hydroxymethyl)propanoate

  • CAS No. 99116-11-7

  • Cat. No. CS-B1343
  • Purity≥95%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

Ethyl 3-hydroxy-2-(hydroxymethyl)propanoate|CS-B1343

Structure of 99116-11-7

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General Information

  • CAS No. 99116-11-7
  • Cat. No. CS-B1343
  • Purity ≥95%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₂O₄
  • Molecular Weight 148.16
  • Synonym(s) Propanoic acid, 3-hydroxy-2-(hydroxymethyl)-, ethyl ester
  • SMILES O=C(OCC)C(CO)CO

Description

Ethyl 3-hydroxy-2-(hydroxymethyl)propanoate features a bifunctional hydroxyl array and a pendant ester group, enabling straightforward derivatization in synthetic sequences. This moisture-tolerant scaffold integrates readily into complex molecular architectures under standard conditions, offering high compatibility with diverse reaction manifolds.

Application

Ethyl 3-hydroxy-2-(hydroxymethyl)propanoate serves as a versatile synthon in organic synthesis, enabling the construction of complex carbohydrate mimetics and bioactive heterocycles. Its orthogonal hydroxyl groups facilitate selective protection and functionalization, while the ester moiety supports downstream transformations such as reduction, oxidation, or coupling reactions. The molecule exhibits bench stability and is compatible with standard purification protocols, making it a practical building block for medicinal chemistry and process development workflows.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P280-P302+P352

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Computational Chemistry Data

  • TPSA   66.76
  • LogP   -0.8497
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   4

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