Home Halogens 3-(bromodifluoromethyl)-1H-pyrazole

3-(bromodifluoromethyl)-1H-pyrazole

CAS No.:
2044797-26-2
Catalog Number:
AG01BVBA
Molecular Formula:
C4H3BrF2N2
Molecular Weight:
196.9808
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BVBA
Chemical Name:
3-(bromodifluoromethyl)-1H-pyrazole
CAS Number:
2044797-26-2
Molecular Formula:
C4H3BrF2N2
Molecular Weight:
196.9808
MDL Number:
MFCD30486581
IUPAC Name:
5-[bromo(difluoro)methyl]-1H-pyrazole
InChI:
InChI=1S/C4H3BrF2N2/c5-4(6,7)3-1-2-8-9-3/h1-2H,(H,8,9)
InChI Key:
FFTUQWMJMICUBW-UHFFFAOYSA-N
SMILES:
FC(c1cc[nH]n1)(Br)F
Properties
Complexity:
109  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.945g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.983g/mol
Monoisotopic Mass:
195.945g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties