3-Hydroxy-2,2-bis(hydroxymethyl)propyl (5xi,9beta)-abieta-7,13-dien-19-oate | CAS No. 8050-26-8

3-Hydroxy-2,2-bis(hydroxymethyl)propyl (5xi,9beta)-abieta-7,13-dien-19-oate

Basic Information

CAS Number

8050-26-8

Molecular Formula

C25H40O5

Molecular Weight

420.59 g/mol

EINECS

232-479-9

AD

Basic Physical Properties

CC(C)C1=CC2=CCC3[C@@]([C@@H]2CC1)(CCC[C@]3(C)C(=O)OCC(CO)(CO)CO)C

InChI

InChI=1S/C25H40O5/c1-17(2)18-6-8-20-19(12-18)7-9-21-23(20,3)10-5-11-24(21,4)22(29)30-16-25(13-26,14-27)15-28/h7,12,17,20-21,26-28H,5-6,8-11,13-16H2,1-4H3/t20-,21?,23-,24+/m1/s1

InChIKey

DUTZBUOZKIIFTG-FXXYKOEOSA-N

LogP

3.6281000000000017

Topological Polar Surface Area

86.99000000000001 Ų

Hydrogen Bond Donor/Acceptor

3 / 5

Synonyms & References

English

  • Resin acids and Rosin acids, esters with pentaerythritol
  • PENTAERYTHRITYL ROSINATE
  • ROSIN,PENTAERYTHRITOLESTER
  • Rosin Penta Ester
  • Resin acid pentaerythritol esters
  • Pentaerythritol ester of wood resin
  • TIANFU-CHEM CAS:8050-26-8 Resin acids and Rosin acids, esters with pentaerythritol
  • Pentaerythritol rosin ester
  • Resin acids, esterswith pentaerythritol
  • PENTAERYTHRITOL ESTER OF ROSIN
  • Pentaerythritol rosinate

EC Number

232-479-9

FAQ

What are the physical and chemical properties of 3-Hydroxy-2,2-bis(hydroxymethyl)propyl (5xi,9beta)-abieta-7,13-dien-19-oate (CAS: 8050-26-8)?

The compound has a crystalline form at room temperature. Its molecular weight is approximately 464.5 g/mol. It is poorly soluble in water but soluble in organic solvents like ethanol and acetone. It exhibits limited reactivity, mostly undergoing esterification reactions. It has a specific gravity around 1.08 g/cm³.

How is 3-Hydroxy-2,2-bis(hydroxymethyl)propyl (5xi,9beta)-abieta-7,13-dien-19-oate (CAS: 8050-26-8) typically synthesized?

This compound is synthesized via a multistep process involving the esterification of 5xi,9beta-abieta-7,13-dien-19-oic acid with 3-hydroxy-2,2-bis(hydroxymethyl)propyl alcohol. Common catalysts include acid or base catalysts, and the reaction is typically carried out in organic solvents under mild to moderate conditions, achieving a yield of about 75-85%.

What industries use 3-Hydroxy-2,2-bis(hydroxymethyl)propyl (5xi,9beta)-abieta-7,13-dien-19-oate (CAS: 8050-26-8)?

This compound is used in the pharmaceutical industry as a raw material for drug synthesis, as well as in the polymer industry for the development of novel materials. It also finds applications in the production of sensors and semiconductors due to its structural complexity and functionality.

What precautions should be taken when handling 3-Hydroxy-2,2-bis(hydroxymethyl)propyl (5xi,9beta)-abieta-7,13-dien-19-oate (CAS: 8050-26-8)?

When handling this compound, appropriate personal protective equipment (PPE) should be worn, including gloves, goggles, and a lab coat. Work should be conducted in a fume hood to minimize inhalation risks. Spills should be cleaned up using absorbent materials and proper waste disposal procedures should be followed. Always refer to the Safety Data Sheet (SDS) for detailed safety information.

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