1-Phenyl-3-oxabicyclo[3.1.0]Hexan-2-one

Name: 1-Phenyl-3-oxabicyclo[3.1.0]Hexan-2-one
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CAS No. 63106-93-4
Cat. No. CS-0454361
Purity≥98%
MDL No.None

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1-Phenyl-3-oxabicyclo[3.1.0]Hexan-2-one|CS-0454361

Structure of 63106-93-4

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Description

1-Phenyl-3-oxabicyclo[3.1.0]hexan-2-one features a rigid, fused bicyclic framework with a strategically positioned ketone and oxygen heteroatom. This configuration imparts high stability and distinct electronic properties, enabling its use in asymmetric synthesis and as a building block for complex cyclic architectures.

Application

1-Phenyl-3-oxabicyclo[3.1.0]hexan-2-one serves as a versatile bicyclic scaffold for stereoselective synthesis, enabling efficient access to complex carbocyclic and heterocyclic frameworks. Its strained bridgehead ketone and embedded ether functionality support a range of transformations including nucleophilic additions and cycloadditions. The compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for iterative synthetic sequences in medicinal chemistry and natural product synthesis.

General Information

CAS No. 63106-93-4
Cat. No. CS-0454361
Purity ≥98%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₁₀O₂
Molecular Weight 174.20
Synonym(s) Milnacipran HClPI-1
SMILES C1=CC=C(C=C1)C23CC3COC2=O

Computational Chemistry Data

TPSA 26.3
LogP 1.5011
H_Acceptors 2
H_Donors 0
Rotatable_Bonds 1

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-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Other Classifications

Building Blocks Skeleton Bridge Rings compounds Other bridge ring compounds

Key Words

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1-Phenyl-3-oxabicyclo[3.1.0]Hexan-2-one

CAS No. 63106-93-4

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