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1426291-17-9,MFCD16652983
Catalog No.:AA01AQFD
1426291-17-9 | 5-Azetidin-3-yl-3-(2-methoxyphenyl)-1,2,4-oxadiazole hydrochloride
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Technical Information
Catalog Number:
AA01AQFD
Chemical Name:
5-Azetidin-3-yl-3-(2-methoxyphenyl)-1,2,4-oxadiazole hydrochloride
CAS Number:
1426291-17-9
Molecular Formula:
C12H14ClN3O2
Molecular Weight:
267.7115
MDL Number:
MFCD16652983
IUPAC Name:
5-(azetidin-3-yl)-3-(2-methoxyphenyl)-1,2,4-oxadiazole;hydrochloride
InChI:
InChI=1S/C12H13N3O2.ClH/c1-16-10-5-3-2-4-9(10)11-14-12(17-15-11)8-6-13-7-8;/h2-5,8,13H,6-7H2,1H3;1H
InChI Key:
GQNVSXOKXDVLBL-UHFFFAOYSA-N
SMILES:
COc1ccccc1c1noc(n1)C1CNC1.Cl
Properties
Computed Properties
 
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.077g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
267.713g/mol
Monoisotopic Mass:
267.077g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
5-azetidin-3-yl-3-(2-methoxyphenyl)-1,2,4-oxadiazole hydrochloride 
1426291-17-9 
AKOS026676893 
L-3905 
F2145-0229 
5-(azetidin-3-yl)-3-(2-methoxyphenyl)-1,2,4-oxadiazole hydrochloride 
Literature
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