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CS-W001157 4
Total: USD 88.00

Spiro[2.5]octane-6-carboxylic acid

  • CAS No. 1086399-13-4

  • Cat. No. CS-0088389
  • Purity≥95%
  • MDL No.MFCD11501504

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

Spiro[2.5]octane-6-carboxylic acid|CS-0088389

Structure of 1086399-13-4

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General Information

  • CAS No. 1086399-13-4
  • Cat. No. CS-0088389
  • Purity ≥95%
  • MDL No. MFCD11501504
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₄O₂
  • Molecular Weight 154.21
  • Synonym(s) SPIO[2.5]OCTANE-6-CARBOXYLIC ACID
  • SMILES O=C(O)C1CCC2(CC2)CC1

Description

Spiro[2.5]octane-6-carboxylic acid features a rigid spirocyclic core that imparts exceptional conformational stability, enabling precise spatial control in molecular design. The pendant carboxylic acid group offers a versatile handle for derivatization via amide or ester formation, facilitating integration into complex architectures for medicinal chemistry and materials applications.

Application

Spiro[2.5]octane-6-carboxylic acid serves as a rigid, three-dimensional building block for medicinal chemistry and materials science. Its spirocyclic core imparts conformational stability and enhances metabolic resistance, while the carboxylic acid functionality enables straightforward derivatization via amide coupling, esterification, or salt formation. The molecule exhibits excellent bench stability and facilitates purification by standard chromatographic methods, making it a practical scaffold for library synthesis and target-oriented compound development.

Safety Information

Download SDS
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-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.0414
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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