ethyl 3-[(phenylsulfonyl)methyl]-1,2,4-oxadiazole-5-carboxylate


Chemical Name: ethyl 3-[(phenylsulfonyl)methyl]-1,2,4-oxadiazole-5-carboxylate
CAS Number: 72660-82-3
Product Number: AG00IQVE(AGN-PC-0WAUPN)
Synonyms:
MDL No: MFCD04125644
Molecular Formula: C12H12N2O5S
Molecular Weight: 296.2991

Identification/Properties


Computed Properties
Molecular Weight:
296.297g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
6
Exact Mass:
296.047g/mol
Monoisotopic Mass:
296.047g/mol
Topological Polar Surface Area:
108A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
428
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

Safety Information


NMR Spectrum


Other Analytical Data


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