(2-Phenyloxazol-4-yl)methanol

Name: (2-Phenyloxazol-4-yl)methanol
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CAS No. 59398-98-0
Cat. No. CS-0094496
Purity≥97%
MDL No.MFCD06738534

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(2-Phenyloxazol-4-yl)methanol|CS-0094496

Structure of 59398-98-0

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General Information

CAS No. 59398-98-0
Cat. No. CS-0094496
Purity ≥97%
MDL No. MFCD06738534
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₉NO₂
Molecular Weight None
Synonym(s) (2-phenyl-4-oxazolyl)methanol
SMILES OCC1=COC(C2=CC=CC=C2)=N1

Description

This oxazolylmethanol integrates a phenyl-substituted oxazole ring with a reactive primary alcohol, enabling straightforward derivatization. The moiety exhibits favorable solubility in common organic solvents and stability under standard bench conditions, making it suitable for synthetic intermediates in medicinal chemistry and materials science applications.

Application

(2-Phenyloxazol-4-yl)methanol serves as a versatile building block in medicinal chemistry, enabling efficient access to oxazole-based scaffolds through straightforward functional group manipulation. Its benzylic alcohol functionality facilitates derivatization via oxidation, protection, or coupling reactions, while the oxazole ring provides metabolic stability and favorable physicochemical properties. The compound exhibits excellent bench stability and is compatible with standard synthetic workflows, making it well-suited for high-throughput library synthesis and process development.

Synthesis

Route1
- 53872-19-8
- ~87%
- In-stock
  
  59398-98-0
References
- Yoo, Sang-Ku Tetrahedron Letters, 1992 , vol. 33, # 16 p. 2159 - 2162
Route2
- In-stock
  
  6704-31-0
- In-stock
  
  55-21-0
- ~36%
- In-stock
  
  59398-98-0
References
- Orr, David; Tolfrey, Alexandra; Percy, Jonathan M.; Frieman, Joanna; Harrison, Zoe A.; Campbell-Crawford, Matthew; Patel, Vipulkumar K. Chemistry - A European Journal, 2013 , vol. 19, # 29 p. 9655 - 9662
Route3
- In-stock
  
  23012-16-0
- ~%
- In-stock
  
  59398-98-0
References
- Zylstra, Eric J.; She, Miles W.-L.; Salamant, Walter A.; Leahy, James W. Synlett, 2007 , # 4 p. 623 - 627

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-H319
Precautionary Statements : P264-P270-P280-P301+P310-P305+P351+P338-P330-P337+P313-P501

Quality Control

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Computational Chemistry Data

TPSA 46.26
LogP 1.8339
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 2

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Oxazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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(2-Phenyloxazol-4-yl)methanol

CAS No. 59398-98-0

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