Home Carboxys Ethyl 5-tert-butyl-1,2,4-oxadiazole-3-carboxylate

Ethyl 5-tert-butyl-1,2,4-oxadiazole-3-carboxylate

CAS No.:
158154-63-3
Catalog Number:
AG001Q0Q
Molecular Formula:
C9H14N2O3
Molecular Weight:
198.2191
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$108
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Product Description
Catalog Number:
AG001Q0Q
Chemical Name:
Ethyl 5-tert-butyl-1,2,4-oxadiazole-3-carboxylate
CAS Number:
158154-63-3
Molecular Formula:
C9H14N2O3
Molecular Weight:
198.2191
MDL Number:
MFCD11975623
IUPAC Name:
ethyl 5-tert-butyl-1,2,4-oxadiazole-3-carboxylate
InChI:
InChI=1S/C9H14N2O3/c1-5-13-7(12)6-10-8(14-11-6)9(2,3)4/h5H2,1-4H3
InChI Key:
GFVSTGOEPQIEAQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1noc(n1)C(C)(C)C
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.1g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.222g/mol
Monoisotopic Mass:
198.1g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties