Home Halogens 4-chloro-2-(difluoromethyl)-1H-1,3-benzodiazole

4-chloro-2-(difluoromethyl)-1H-1,3-benzodiazole

CAS No.:
1342424-21-8
Catalog Number:
AG01E8I5
Molecular Formula:
C8H5ClF2N2
Molecular Weight:
202.5885
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Product Description
Catalog Number:
AG01E8I5
Chemical Name:
4-chloro-2-(difluoromethyl)-1H-1,3-benzodiazole
CAS Number:
1342424-21-8
Molecular Formula:
C8H5ClF2N2
Molecular Weight:
202.5885
MDL Number:
MFCD20390926
IUPAC Name:
4-chloro-2-(difluoromethyl)-1H-benzimidazole
InChI:
InChI=1S/C8H5ClF2N2/c9-4-2-1-3-5-6(4)13-8(12-5)7(10)11/h1-3,7H,(H,12,13)
InChI Key:
QLGGJNSAAQWRRN-UHFFFAOYSA-N
SMILES:
FC(c1nc2c([nH]1)cccc2Cl)F
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.011g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
202.589g/mol
Monoisotopic Mass:
202.011g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties