Home Halogens 4-(bromomethyl)-3-(difluoromethyl)-1-methyl-1H-pyrazole

4-(bromomethyl)-3-(difluoromethyl)-1-methyl-1H-pyrazole

CAS No.:
1694474-39-9
Catalog Number:
AG01ACUN
Molecular Formula:
C6H7BrF2N2
Molecular Weight:
225.0340
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Product Description
Catalog Number:
AG01ACUN
Chemical Name:
4-(bromomethyl)-3-(difluoromethyl)-1-methyl-1H-pyrazole
CAS Number:
1694474-39-9
Molecular Formula:
C6H7BrF2N2
Molecular Weight:
225.0340
MDL Number:
MFCD26936137
IUPAC Name:
4-(bromomethyl)-3-(difluoromethyl)-1-methylpyrazole
InChI:
InChI=1S/C6H7BrF2N2/c1-11-3-4(2-7)5(10-11)6(8)9/h3,6H,2H2,1H3
InChI Key:
CHYFCXVZKDSFGB-UHFFFAOYSA-N
SMILES:
BrCc1cn(nc1C(F)F)C
Properties
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.976g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.037g/mol
Monoisotopic Mass:
223.976g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties