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

5-(TRIFLUOROMETHYL)FURAN-2-CARBONITRILE

CAS No.:
65865-27-2
Catalog Number:
AG01C8G1
Molecular Formula:
C6H2F3NO
Molecular Weight:
161.0814
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Product Description
Catalog Number:
AG01C8G1
Chemical Name:
5-(TRIFLUOROMETHYL)FURAN-2-CARBONITRILE
CAS Number:
65865-27-2
Molecular Formula:
C6H2F3NO
Molecular Weight:
161.0814
MDL Number:
MFCD22492836
IUPAC Name:
5-(trifluoromethyl)furan-2-carbonitrile
InChI:
InChI=1S/C6H2F3NO/c7-6(8,9)5-2-1-4(3-10)11-5/h1-2H
InChI Key:
AOHPUOFCTXGLBJ-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(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:
161.009g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.083g/mol
Monoisotopic Mass:
161.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties