Isoxazole, 5-phenyl- structure

Isoxazole, 5-phenyl-

5-phenyl-1,2-oxazole

Also Known As: 5-phenylisoxazole|Isoxazole, 5-phenyl-|5-phenyl-1,2-oxazole|5-Phenyl-isoxazole|5-Phenylisoxazol|1-(Isoxazol-5-yl)benzene|5-Phenylisoxazole, AldrichCPR|BUTTPARK 81\09-55|KS-000017NW|5903AH|TD1025|PS-4277|K-0184

CAS: 1006-67-3
Molecular Formula C9H7NO
Molecular Weight 145.05276 g/mol
LogP 2.0
Topological Polar Surface Area 26.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 1
Exact Mass 145.05276
Monoisotopic Mass 145.05276
Heavy Atoms 11
Complexity 121.0

Chemical Identifiers

CAS Number 1006-67-3
SMILES C1=CC=C(C=C1)C2=CC=NO2
InChIKey BXQDLEHCXQQSCH-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (22 patents) Heterocyclic Building Blocks (70 patents) Organic Building Blocks (25 patents) Organometallic Reagents (8 patents) Peptides & Amino Acids (3 patents) Pharmaceutical Intermediates (14 patents) Photographic Chemicals (1 patents) Polymer Intermediates (2 patents)

Product Overview

Isoxazole, 5-phenyl- (CAS 1006-67-3), with molecular formula C9H7NO and molecular weight 145.05276 g/mol. IUPAC: 5-phenyl-1,2-oxazole.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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