(1R)-1-((4R,4aR,8aS)-2,6-Bis(3,4-dimethylphenyl)tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)ethane-1,2-diol

Name: (1R)-1-((4R,4aR,8aS)-2,6-Bis(3,4-dimethylphenyl)tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)ethane-1,2-diol
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CAS No. 135861-56-2
Cat. No. CS-0162395
Molecule weight414.49
Purity≥96%
MDL No.MFCD09038711

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(1R)-1-((4R,4aR,8aS)-2,6-Bis(3,4-dimethylphenyl)tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)ethane-1,2-diol|CS-0162395

Structure of 135861-56-2

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General Information

CAS No. 135861-56-2
Cat. No. CS-0162395
Purity ≥96%
MDL No. MFCD09038711
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₂₄H₃₀O₆
Molecular Weight 414.49
Synonym(s) Nucleating Agent SW-ZC-3988
SMILES O[C@@H]([C@@H]1[C@@](OC(C2=CC=C(C)C(C)=C2)OC3)([H])[C@@]3([H])OC(C4=CC=C(C)C(C)=C4)O1)CO

Description

This chiral diol features a rigid, polycyclic scaffold with dual aryl substituents that confer enhanced stability and solubility in organic media. The (1R) configuration enables stereoselective transformations, while the protected hydroxyl groups facilitate controlled functionalization in synthesis. Ideal for asymmetric catalysis and complex molecule assembly.

Application

(1R)-1-((4R,4aR,8aS)-2,6-Bis(3,4-dimethylphenyl)tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)ethane-1,2-diol serves as a chiral scaffold for asymmetric synthesis, leveraging its rigid, polycyclic architecture and multiple hydroxyl functionalities. The molecule exhibits bench stability and facilitates selective derivatization under standard conditions, enabling efficient construction of complex molecular frameworks. Its functional group tolerance supports downstream transformations in medicinal chemistry and catalyst design.

Synthesis

Route1
- In-stock
  
  5973-71-7
- In-stock
  
  50-70-4
- ~96%
- In-stock
  
  135861-56-2
References
- US2006/79720 A1, ; Page/Page column 4 ;

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-H319
Precautionary Statements : P264-P270-P280-P330-P501

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Computational Chemistry Data

TPSA 77.38
LogP 3.17028
H_Acceptors 6
H_Donors 2
Rotatable_Bonds 4

Other Classifications

Building Blocks Skeleton Aliphatic heterocycle compounds Other aliphatic heterocycles compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Building Blocks Skeleton Chiral compounds Chiral Building Blocks

Material Science Polymer/Macromolecule Reagents Polymer Additives Nucleating Agents

Key Words

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(1R)-1-((4R,4aR,8aS)-2,6-Bis(3,4-dimethylphenyl)tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-4-yl)ethane-1,2-diol

CAS No. 135861-56-2

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