5-(6-Methyl-1,3-benzoxazol-2-yl)-1,3,4-oxadiazol-2(3H)-one

Base Information

• Chemical Name: 5-(6-Methyl-1,3-benzoxazol-2-yl)-1,3,4-oxadiazol-2(3H)-one
• CAS No.: 78620-17-4
• Molecular Formula: C10H7N3O3
• ChEMBL ID: CHEMBL22354
• DSSTox Substance ID: DTXSID40517980
• Wikidata: Q82380307

Synonyms:78620-17-4;5-(6-Methylbenzo[d]oxazol-2-yl)-1,3,4-oxadiazol-2(3H)-one;CHEMBL22354;SCHEMBL11395473;DTXSID40517980;5-(6-Methyl-1,3-benzoxazol-2-yl)-1,3,4-oxadiazol-2(3H)-one

Chemical Property of 5-(6-Methyl-1,3-benzoxazol-2-yl)-1,3,4-oxadiazol-2(3H)-one

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 217.04874109
• Heavy Atom Count: 16
• Complexity: 344

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1)N=C(O2)C3=NNC(=O)O3

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