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Home Halogens 3-(4-(tert-Butyl)phenyl)-5-(chloromethyl)-1,2,4-oxadiazole

3-(4-(tert-Butyl)phenyl)-5-(chloromethyl)-1,2,4-oxadiazole

CAS No.:
175204-40-7
Catalog Number:
AG0020MC
Molecular Formula:
C13H15ClN2O
Molecular Weight:
250.7240
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$117
- +
5g
1 week
United States
$413
- +
Product Description
Catalog Number:
AG0020MC
Chemical Name:
3-(4-(tert-Butyl)phenyl)-5-(chloromethyl)-1,2,4-oxadiazole
CAS Number:
175204-40-7
Molecular Formula:
C13H15ClN2O
Molecular Weight:
250.7240
MDL Number:
MFCD00124908
IUPAC Name:
3-(4-tert-butylphenyl)-5-(chloromethyl)-1,2,4-oxadiazole
InChI:
InChI=1S/C13H15ClN2O/c1-13(2,3)10-6-4-9(5-7-10)12-15-11(8-14)17-16-12/h4-7H,8H2,1-3H3
InChI Key:
ZLQQUIHBQATFOP-UHFFFAOYSA-N
SMILES:
ClCc1onc(n1)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.087g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.726g/mol
Monoisotopic Mass:
250.087g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties