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CS-W001157 4
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Hept-6-yn-1-amine

  • CAS No. 14502-42-2

  • Cat. No. CS-0104826
  • Purity≥95%
  • MDL No.MFCD19203750

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

Hept-6-yn-1-amine|CS-0104826

Structure of 14502-42-2

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General Information

  • CAS No. 14502-42-2
  • Cat. No. CS-0104826
  • Purity ≥95%
  • MDL No. MFCD19203750
  • Storage -20°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₃N
  • Molecular Weight 111.19
  • Synonym(s) 7-Amino-1-heptyne
  • SMILES C#CCCCCCN

Description

Hept-6-yn-1-amine features a terminal alkyne group flanked by a primary amine, enabling efficient conjugation in click chemistry and bioorthogonal labeling. This bifunctional scaffold integrates readily into peptide and polymer architectures, offering high reactivity under standard conditions with minimal side reactions.

Application

Hept-6-yn-1-amine serves as a versatile alkyne-containing building block for click chemistry and transition-metal-catalyzed couplings. Its terminal alkyne functionality enables efficient CuAAC reactions, while the primary amine facilitates conjugation or derivatization. The molecule exhibits good bench stability and is compatible with common protecting group strategies, making it suitable for modular synthesis of bioactive heterocycles and functionalized scaffolds in medicinal chemistry workflows.

Safety Information

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GHS Pictogram :
GHS No : GHS02,GHS05,GHS07
Signal Word : Danger
UN#: 2734
Class : 8,3
Packing Group : Ⅱ
Hazard Statements : H226-H302-H314
Precautionary Statements : P210-P233-P240-P241-P242-P243-P260-P264-P270-P280-P301+P330+P331-P304+P340-P330-P363-P370+P378-P405-P501

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   1.1387
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   4

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