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CS-W001157 4
Total: USD 88.00

(trans,trans)-4-Propyl-4'-vinyl-1,1'-bi(cyclohexane)

  • CAS No. 116020-44-1

  • Cat. No. CS-0152581
  • Purity≥98%
  • MDL No.MFCD11045059

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

(trans,trans)-4-Propyl-4'-vinyl-1,1'-bi(cyclohexane)|CS-0152581

Structure of 116020-44-1

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General Information

  • CAS No. 116020-44-1
  • Cat. No. CS-0152581
  • Purity ≥98%
  • MDL No. MFCD11045059
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₃₀
  • Molecular Weight 234.42
  • Synonym(s) trans,trans-4-Propyl-4'-vinylbicyclohexyl
  • SMILES CCC[C@H]1CC[C@@H](CC1)[C@H]2CC[C@H](C=C)CC2

Description

This (trans,trans)-4-Propyl-4'-vinyl-1,1'-bi(cyclohexane) features a rigid, sterically defined biphenyl-like scaffold with complementary functional handles: a propyl group and a vinyl moiety. The trans,trans configuration enforces conformational stability, enabling predictable spatial orientation in molecular design. This structure integrates seamlessly into polymer backbones or serves as a building block for advanced materials requiring controlled architecture and enhanced thermal resilience.

Application

(trans,trans)-4-Propyl-4'-vinyl-1,1'-bi(cyclohexane) serves as a rigid, sterically defined scaffold for constructing functionalized cyclohexane-based architectures. Its vinyl group enables straightforward cross-coupling and Diels–Alder reactions, while the trans,trans-diaxial substitution ensures high conformational stability. The molecule exhibits excellent bench stability and facilitates purification via standard chromatographic methods, making it well-suited for iterative synthesis in medicinal chemistry and materials science applications.

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-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   0
  • LogP   5.5853
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   4

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