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CS-W001157 4
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2-(Azepan-1-yl)acetic acid

  • CAS No. 52703-80-7

  • Cat. No. CS-0072006
  • Molecule weight157.21
  • Purity≥97%
  • MDL No.None

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

2-(Azepan-1-yl)acetic acid|CS-0072006

Structure of 52703-80-7

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General Information

  • CAS No. 52703-80-7
  • Cat. No. CS-0072006
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₅NO₂
  • Molecular Weight 157.21
  • Synonym(s) Azepan-1-ylacetic acid
  • SMILES O=C(O)CN1CCCCCC1

Description

2-(Azepan-1-yl)acetic acid features a seven-membered azepane ring tethered to a carboxylic acid group, enabling versatile integration into bioactive molecules. The amine-bearing side chain facilitates conjugation and solubility enhancement in drug discovery scaffolds. This compound serves as a key intermediate for targeted synthesis of functionalized analogs in medicinal chemistry applications.

Application

2-(Azepan-1-yl)acetic acid serves as a versatile scaffold for medicinal chemistry, enabling the construction of bioactive heterocycles and drug-like molecules. Its pendant amine facilitates conjugation and derivatization, while the carboxylic acid group supports efficient coupling reactions. The compound exhibits bench stability and tolerates diverse functional groups, making it well-suited for iterative synthesis workflows in API 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   40.54
  • LogP   0.947
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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