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83318-24-5

83318-24-5 | 1H-Benzimidazol-2-amine, N-[4-chloro-3-(trifluoromethyl)phenyl]-

CAS No: 83318-24-5 Catalog No: AG004T0M MDL No:

Product Description

Catalog Number:
AG004T0M
Chemical Name:
1H-Benzimidazol-2-amine, N-[4-chloro-3-(trifluoromethyl)phenyl]-
CAS Number:
83318-24-5
Molecular Formula:
C14H9ClF3N3
Molecular Weight:
311.6896
IUPAC Name:
N-[4-chloro-3-(trifluoromethyl)phenyl]-1H-benzimidazol-2-amine
InChI:
InChI=1S/C14H9ClF3N3/c15-10-6-5-8(7-9(10)14(16,17)18)19-13-20-11-3-1-2-4-12(11)21-13/h1-7H,(H2,19,20,21)
InChI Key:
GVORIUUNVSHUSR-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1C(F)(F)F)Nc1nc2c([nH]1)cccc2

Properties

Complexity:
366  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.044g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
311.692g/mol
Monoisotopic Mass:
311.044g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  

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