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1286708-63-1,MFCD16652924
Catalog No.:AA01AQL7
1286708-63-1 | 5-Azetidin-3-yl-3-(2-thienyl)-1,2,4-oxadiazole hydrochloride
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Technical Information
Catalog Number:
AA01AQL7
Chemical Name:
5-Azetidin-3-yl-3-(2-thienyl)-1,2,4-oxadiazole hydrochloride
CAS Number:
1286708-63-1
Molecular Formula:
C9H10ClN3OS
Molecular Weight:
243.7132
MDL Number:
MFCD16652924
IUPAC Name:
5-(azetidin-3-yl)-3-thiophen-2-yl-1,2,4-oxadiazole;hydrochloride
InChI:
InChI=1S/C9H9N3OS.ClH/c1-2-7(14-3-1)8-11-9(13-12-8)6-4-10-5-6;/h1-3,6,10H,4-5H2;1H
InChI Key:
QEHYYUZHXRFAHG-UHFFFAOYSA-N
SMILES:
N1CC(C1)c1onc(n1)c1cccs1.Cl
Properties
Computed Properties
 
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.023g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
243.709g/mol
Monoisotopic Mass:
243.023g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
5-azetidin-3-yl-3-(2-thienyl)-1,2,4-oxadiazole hydrochloride 
1286708-63-1 
CHEMBL3497388 
AKOS026676884 
L-5121 
F2145-0109 
Literature
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