Home Nitros 4-fluoro-5-(1H-imidazol-1-yl)-2-nitroaniline

4-fluoro-5-(1H-imidazol-1-yl)-2-nitroaniline

CAS No.:
216883-13-5
Catalog Number:
AG019KXW
Molecular Formula:
C9H7FN4O2
Molecular Weight:
222.1759
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Product Description
Catalog Number:
AG019KXW
Chemical Name:
4-fluoro-5-(1H-imidazol-1-yl)-2-nitroaniline
CAS Number:
216883-13-5
Molecular Formula:
C9H7FN4O2
Molecular Weight:
222.1759
MDL Number:
MFCD09802105
IUPAC Name:
4-fluoro-5-imidazol-1-yl-2-nitroaniline
InChI:
InChI=1S/C9H7FN4O2/c10-6-3-9(14(15)16)7(11)4-8(6)13-2-1-12-5-13/h1-5H,11H2
InChI Key:
JPUAGHMSXTVEGG-UHFFFAOYSA-N
SMILES:
Fc1cc([N+](=O)[O-])c(cc1n1cncc1)N
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.055g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.179g/mol
Monoisotopic Mass:
222.055g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
89.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties