methyl 3-phenyl-1,2,4-oxadiazole-5-carboxylate


Chemical Name: methyl 3-phenyl-1,2,4-oxadiazole-5-carboxylate
CAS Number: 259150-97-5
Product Number: AG002R19(AGN-PC-010DY8)
Synonyms:
MDL No:
Molecular Formula: C10H8N2O3
Molecular Weight: 204.1821

Identification/Properties


Computed Properties
Molecular Weight:
204.185g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
204.053g/mol
Monoisotopic Mass:
204.053g/mol
Topological Polar Surface Area:
65.2A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
229
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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