Home Other Building Blocks 3-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]propan-1-amine hydrochloride

3-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]propan-1-amine hydrochloride

CAS No.:
1909319-53-4
Catalog Number:
AG01C4JW
Molecular Formula:
C6H9ClF3N3O
Molecular Weight:
231.6034
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Product Description
Catalog Number:
AG01C4JW
Chemical Name:
3-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]propan-1-amine hydrochloride
CAS Number:
1909319-53-4
Molecular Formula:
C6H9ClF3N3O
Molecular Weight:
231.6034
MDL Number:
MFCD29763134
IUPAC Name:
3-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]propan-1-amine;hydrochloride
InChI:
InChI=1S/C6H8F3N3O.ClH/c7-6(8,9)5-11-4(12-13-5)2-1-3-10;/h1-3,10H2;1H
InChI Key:
UDCNFHZBDNCNQQ-UHFFFAOYSA-N
SMILES:
NCCCc1noc(n1)C(F)(F)F.Cl
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.039g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
231.603g/mol
Monoisotopic Mass:
231.039g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties