Home Other Building Blocks 5-(TRIFLUOROMETHYL)FURAN-2-CARBOXAMIDE

5-(TRIFLUOROMETHYL)FURAN-2-CARBOXAMIDE

CAS No.:
56286-74-9
Catalog Number:
AG01E72B
Molecular Formula:
C6H4F3NO2
Molecular Weight:
179.0967
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Product Description
Catalog Number:
AG01E72B
Chemical Name:
5-(TRIFLUOROMETHYL)FURAN-2-CARBOXAMIDE
CAS Number:
56286-74-9
Molecular Formula:
C6H4F3NO2
Molecular Weight:
179.0967
MDL Number:
MFCD00729095
IUPAC Name:
5-(trifluoromethyl)furan-2-carboxamide
InChI:
InChI=1S/C6H4F3NO2/c7-6(8,9)4-2-1-3(12-4)5(10)11/h1-2H,(H2,10,11)
InChI Key:
JEBRGGLRJRFWDP-UHFFFAOYSA-N
SMILES:
NC(=O)c1ccc(o1)C(F)(F)F
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.019g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
179.098g/mol
Monoisotopic Mass:
179.019g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties