1,3,4-Oxadiazole, 2-methyl-5-(4-nitrophenyl)-


Chemical Name: 1,3,4-Oxadiazole, 2-methyl-5-(4-nitrophenyl)-
CAS Number: 22815-99-2
Product Number: AG00BIYL(AGN-PC-0JSKZA)
Synonyms:
MDL No:
Molecular Formula: C9H7N3O3
Molecular Weight: 205.1702

Identification/Properties


Computed Properties
Molecular Weight:
205.173g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
205.049g/mol
Monoisotopic Mass:
205.049g/mol
Topological Polar Surface Area:
84.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
235
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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Chemical Structure



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