Home Other Building Blocks 5-(1H-1,3-benzodiazol-2-yl)-2-fluoroaniline

5-(1H-1,3-benzodiazol-2-yl)-2-fluoroaniline

CAS No.:
1183634-12-9
Catalog Number:
AG01AF85
Molecular Formula:
C13H10FN3
Molecular Weight:
227.2370
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Product Description
Catalog Number:
AG01AF85
Chemical Name:
5-(1H-1,3-benzodiazol-2-yl)-2-fluoroaniline
CAS Number:
1183634-12-9
Molecular Formula:
C13H10FN3
Molecular Weight:
227.2370
MDL Number:
MFCD12732357
IUPAC Name:
5-(1H-benzimidazol-2-yl)-2-fluoroaniline
InChI:
InChI=1S/C13H10FN3/c14-9-6-5-8(7-10(9)15)13-16-11-3-1-2-4-12(11)17-13/h1-7H,15H2,(H,16,17)
InChI Key:
KIUORSRTGYXUJW-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1N)c1nc2c([nH]1)cccc2
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.086g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
227.242g/mol
Monoisotopic Mass:
227.086g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties