Home Halogens 1,2,4-Oxadiazole, 5-(chloromethyl)-3-cyclobutyl-

1,2,4-Oxadiazole, 5-(chloromethyl)-3-cyclobutyl-

CAS No.:
1221278-57-4
Catalog Number:
AG0016TB
Molecular Formula:
C7H9ClN2O
Molecular Weight:
172.6122
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Product Description
Catalog Number:
AG0016TB
Chemical Name:
1,2,4-Oxadiazole, 5-(chloromethyl)-3-cyclobutyl-
CAS Number:
1221278-57-4
Molecular Formula:
C7H9ClN2O
Molecular Weight:
172.6122
MDL Number:
MFCD15147267
IUPAC Name:
5-(chloromethyl)-3-cyclobutyl-1,2,4-oxadiazole
InChI:
InChI=1S/C7H9ClN2O/c8-4-6-9-7(10-11-6)5-2-1-3-5/h5H,1-4H2
InChI Key:
BCCZZVBQASSARF-UHFFFAOYSA-N
SMILES:
ClCc1onc(n1)C1CCC1
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.04g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.612g/mol
Monoisotopic Mass:
172.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties