Home Halogens 1H-BenziMidazole, 2-chloro-7-(trifluoroMethyl)-

1H-BenziMidazole, 2-chloro-7-(trifluoroMethyl)-

CAS No.:
1075753-27-3
Catalog Number:
AG0099AW
Molecular Formula:
C8H4ClF3N2
Molecular Weight:
220.5790
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Product Description
Catalog Number:
AG0099AW
Chemical Name:
1H-BenziMidazole, 2-chloro-7-(trifluoroMethyl)-
CAS Number:
1075753-27-3
Molecular Formula:
C8H4ClF3N2
Molecular Weight:
220.5790
MDL Number:
MFCD22562508
IUPAC Name:
2-chloro-4-(trifluoromethyl)-1H-benzimidazole
InChI:
InChI=1S/C8H4ClF3N2/c9-7-13-5-3-1-2-4(6(5)14-7)8(10,11)12/h1-3H,(H,13,14)
InChI Key:
KMDQLFANQXPHKP-UHFFFAOYSA-N
SMILES:
Clc1nc2c([nH]1)c(ccc2)C(F)(F)F
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.002g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.579g/mol
Monoisotopic Mass:
220.002g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties