Home Other Building Blocks 2-tert-Butyl-1,3,4-oxadiazole

2-tert-Butyl-1,3,4-oxadiazole

CAS No.:
251540-53-1
Catalog Number:
AG002QOD
Molecular Formula:
C6H10N2O
Molecular Weight:
126.1564
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$226
- +
1g
97%
In Stock USA
United States
$434
- +
5g
97%
In Stock USA
United States
$1262
- +
Product Description
Catalog Number:
AG002QOD
Chemical Name:
2-tert-Butyl-1,3,4-oxadiazole
CAS Number:
251540-53-1
Molecular Formula:
C6H10N2O
Molecular Weight:
126.1564
MDL Number:
MFCD08689904
IUPAC Name:
2-tert-butyl-1,3,4-oxadiazole
InChI:
InChI=1S/C6H10N2O/c1-6(2,3)5-8-7-4-9-5/h4H,1-3H3
InChI Key:
SETCKKFZFOFBSI-UHFFFAOYSA-N
SMILES:
CC(c1ocnn1)(C)C
Properties
Complexity:
97.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.079g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.159g/mol
Monoisotopic Mass:
126.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Novel inhibitor for prolyl aminopeptidase from Serratia marcescens and studies on the mechanism of substrate recognition of the enzyme using the inhibitor. Archives of biochemistry and biophysics 20030815
Properties