Benzo[d]oxazole-7-carbaldehyde

Name: Benzo[d]oxazole-7-carbaldehyde
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CAS No. 1097180-23-8
Cat. No. CS-0440783
Purity≥97%
MDL No.MFCD20527793

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Benzo[d]oxazole-7-carbaldehyde|CS-0440783

Structure of 1097180-23-8

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General Information

CAS No. 1097180-23-8
Cat. No. CS-0440783
Purity ≥97%
MDL No. MFCD20527793
Storage 4°C, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₅NO₂
Molecular Weight 147.13
Synonym(s) 1,3-Benzoxazole-7-carbaldehyde
SMILES C1=CC(=C2C(=C1)N=CO2)C=O

Description

Benzo[d]oxazole-7-carbaldehyde features a rigid heteroaromatic core with a formyl group at the 7-position, enabling direct incorporation into conjugated systems. This electron-deficient aldehyde serves as a key scaffold for synthesizing bioactive molecules and functional materials, offering enhanced stability under standard conditions.

Application

Benzo[d]oxazole-7-carbaldehyde serves as a versatile building block for heterocyclic synthesis, enabling direct functionalization at the aldehyde position via nucleophilic addition or oxidation. Its stability under standard bench conditions and compatibility with common coupling reactions facilitate efficient access to biologically relevant scaffolds. Functions as a key intermediate in the construction of fused polycyclic systems and drug-like molecules.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 43.1
LogP 1.6403
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Benzooxazole compounds

Key Words

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Benzo[d]oxazole-7-carbaldehyde

CAS No. 1097180-23-8

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