Home Other Building Blocks Benzenamine, 5-fluoro-2-(1H-imidazol-1-yl)-

Benzenamine, 5-fluoro-2-(1H-imidazol-1-yl)-

CAS No.:
251649-52-2
Catalog Number:
AG002QPL
Molecular Formula:
C9H8FN3
Molecular Weight:
177.1783
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Product Description
Catalog Number:
AG002QPL
Chemical Name:
Benzenamine, 5-fluoro-2-(1H-imidazol-1-yl)-
CAS Number:
251649-52-2
Molecular Formula:
C9H8FN3
Molecular Weight:
177.1783
MDL Number:
MFCD02180945
IUPAC Name:
5-fluoro-2-imidazol-1-ylaniline
InChI:
InChI=1S/C9H8FN3/c10-7-1-2-9(8(11)5-7)13-4-3-12-6-13/h1-6H,11H2
InChI Key:
DCSCOECASPLFFN-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)N)n1cncc1
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.07g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.182g/mol
Monoisotopic Mass:
177.07g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties