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Home Other Building Blocks 5-tert-Butyl-3-p-tolyl-1,2,4-oxadiazole

5-tert-Butyl-3-p-tolyl-1,2,4-oxadiazole

CAS No.:
1020253-10-4
Catalog Number:
AG0006D8
Molecular Formula:
C13H16N2O
Molecular Weight:
216.2789
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$150
- +
25g
98%
In Stock USA
United States
$450
- +
100g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG0006D8
Chemical Name:
5-tert-Butyl-3-p-tolyl-1,2,4-oxadiazole
CAS Number:
1020253-10-4
Molecular Formula:
C13H16N2O
Molecular Weight:
216.2789
MDL Number:
MFCD02310122
IUPAC Name:
5-tert-butyl-3-(4-methylphenyl)-1,2,4-oxadiazole
InChI:
InChI=1S/C13H16N2O/c1-9-5-7-10(8-6-9)11-14-12(16-15-11)13(2,3)4/h5-8H,1-4H3
InChI Key:
YYELJJHQDCFHIB-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1noc(n1)C(C)(C)C
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.126g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.284g/mol
Monoisotopic Mass:
216.126g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties