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

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

CAS No.:
1803599-82-7
Catalog Number:
AG01BFQ5
Molecular Formula:
C9H7ClF3N3O
Molecular Weight:
265.6196
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Product Description
Catalog Number:
AG01BFQ5
Chemical Name:
3-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]aniline hydrochloride
CAS Number:
1803599-82-7
Molecular Formula:
C9H7ClF3N3O
Molecular Weight:
265.6196
MDL Number:
MFCD16615315
IUPAC Name:
3-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]aniline;hydrochloride
InChI:
InChI=1S/C9H6F3N3O.ClH/c10-9(11,12)8-14-7(15-16-8)5-2-1-3-6(13)4-5;/h1-4H,13H2;1H
InChI Key:
DAPSDSGLQYWBQJ-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)c1noc(n1)C(F)(F)F.Cl
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.023g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
265.62g/mol
Monoisotopic Mass:
265.023g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties