2,2-Dimethyl-5-carbethoxy-1,3-dioxane

Name: 2,2-Dimethyl-5-carbethoxy-1,3-dioxane
Brand: ChemScene
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CAS No. 82962-54-7
Cat. No. CS-B1510
Purity≥96%
MDL No.MFCD11975772

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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2,2-Dimethyl-5-carbethoxy-1,3-dioxane|CS-B1510

Structure of 82962-54-7

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Description

This 1,3-dioxane derivative features a sterically hindered dimethyl substitution and a pendant carbethoxy group, enabling stable incorporation into complex synthetic sequences. The electron-deficient dioxane ring facilitates controlled reactivity in conjugate addition and cycloaddition processes under standard conditions.

Application

2,2-Dimethyl-5-carbethoxy-1,3-dioxane serves as a stable, bench-ready building block for the synthesis of substituted cyclohexanones and heterocyclic scaffolds. Its protected 1,3-dioxane core exhibits excellent functional group tolerance and facilitates efficient ring-opening reactions with nucleophiles, enabling straightforward access to polyfunctional intermediates. The carbethoxy group supports subsequent transformations such as hydrolysis and decarboxylation, making it valuable in iterative synthetic sequences for medicinal chemistry and natural product synthesis.

General Information

CAS No. 82962-54-7
Cat. No. CS-B1510
Purity ≥96%
MDL No. MFCD11975772
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₁₆O₄
Molecular Weight 188.22
Synonym(s) Ethyl 2,2-dimethyl-1,3-dioxane-5-carboxylate
SMILES O=C(OCC)C1COC(C)(C)OC1

Computational Chemistry Data

TPSA 44.76
LogP 0.9486
H_Acceptors 4
H_Donors 0
Rotatable_Bonds 2

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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Other Classifications

Building Blocks Skeleton Aliphatic heterocycle compounds Other aliphatic heterocycles compounds

Key Words

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2,2-Dimethyl-5-carbethoxy-1,3-dioxane

CAS No. 82962-54-7

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