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

1-[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine hydrochloride

CAS No.:
1394042-32-0
Catalog Number:
AG019ZXM
Molecular Formula:
C12H16ClN3O
Molecular Weight:
253.7279
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Product Description
Catalog Number:
AG019ZXM
Chemical Name:
1-[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]ethan-1-amine hydrochloride
CAS Number:
1394042-32-0
Molecular Formula:
C12H16ClN3O
Molecular Weight:
253.7279
MDL Number:
MFCD22375368
IUPAC Name:
1-[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]ethanamine;hydrochloride
InChI:
InChI=1S/C12H15N3O.ClH/c1-3-9-4-6-10(7-5-9)11-14-12(8(2)13)16-15-11;/h4-8H,3,13H2,1-2H3;1H
InChI Key:
NAHHSQPLPDXLKJ-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1)c1noc(n1)C(N)C.Cl
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.098g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
253.73g/mol
Monoisotopic Mass:
253.098g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties