Benzo[d]oxazol-2-ylmethanol

Name: Benzo[d]oxazol-2-ylmethanol
Brand: ChemScene
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CAS No. 77186-95-9
Cat. No. CS-W019081
Purity≥97%
MDL No.MFCD07368333

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
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General Information

CAS No. 77186-95-9
Cat. No. CS-W019081
Purity ≥97%
MDL No. MFCD07368333
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₇NO₂
Molecular Weight 149.15
Synonym(s) BENZOOXAZOL-2-YL-METHANOL
SMILES O1C2=C(N=C1CO)C=CC=C2

Description

Benzo[d]oxazol-2-ylmethanol features a benzoxazole core with a reactive hydroxymethyl group, enabling direct functionalization in synthetic transformations. This bench-stable scaffold integrates readily into bioactive molecules and serves as a versatile intermediate in medicinal chemistry and materials science applications.

Application

Benzo[d]oxazol-2-ylmethanol serves as a versatile building block in medicinal chemistry, enabling efficient access to bioactive heterocycles. Its benzoxazole core offers enhanced metabolic stability, while the pendant alcohol facilitates derivatization via oxidation, substitution, or coupling reactions. The compound exhibits excellent bench stability and is compatible with standard purification protocols, making it well-suited for modular synthesis of pharmaceutical intermediates and functionalized scaffolds.

Synthesis

Route1
- 408538-63-6
- ~%
- In-stock
  
  77186-95-9
References
- Chemische Berichte, , vol. 55, p. 1097
Route2
- In-stock
  
  79-14-1
- 95-55-6
- ~%
- In-stock
  
  77186-95-9
References
- US2932649 , ; US2877155 , ; US2508324 , ;

Safety Information

Download SDS

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 46.26
LogP 1.3201
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Benzooxazole compounds

Key Words

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Benzo[d]oxazol-2-ylmethanol

CAS No. 77186-95-9

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