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10173-58-7

10173-58-7 | Benzenamine, 2-(1H-benzimidazol-2-yl)-4-fluoro-

CAS No: 10173-58-7 Catalog No: AG0005BV MDL No:

Product Description

Catalog Number:
AG0005BV
Chemical Name:
Benzenamine, 2-(1H-benzimidazol-2-yl)-4-fluoro-
CAS Number:
10173-58-7
Molecular Formula:
C13H10FN3
Molecular Weight:
227.2370
IUPAC Name:
2-(1H-benzimidazol-2-yl)-4-fluoroaniline
InChI:
InChI=1S/C13H10FN3/c14-8-5-6-10(15)9(7-8)13-16-11-3-1-2-4-12(11)17-13/h1-7H,15H2,(H,16,17)
InChI Key:
JNKPOTOPGJEEKF-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)c1nc2c([nH]1)cccc2)N
NSC Number:
128754

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:
2.1  

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