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

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

CAS No.:
1798731-87-9
Catalog Number:
AG01BFSE
Molecular Formula:
C9H8ClF2N3O
Molecular Weight:
247.6291
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Product Description
Catalog Number:
AG01BFSE
Chemical Name:
4-[5-(difluoromethyl)-1,2,4-oxadiazol-3-yl]aniline hydrochloride
CAS Number:
1798731-87-9
Molecular Formula:
C9H8ClF2N3O
Molecular Weight:
247.6291
MDL Number:
MFCD28118707
IUPAC Name:
4-[5-(difluoromethyl)-1,2,4-oxadiazol-3-yl]aniline;hydrochloride
InChI:
InChI=1S/C9H7F2N3O.ClH/c10-7(11)9-13-8(14-15-9)5-1-3-6(12)4-2-5;/h1-4,7H,12H2;1H
InChI Key:
IQSVQMGFDPRCPA-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1noc(n1)C(F)F.Cl
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.032g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
247.63g/mol
Monoisotopic Mass:
247.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties