Home Halogens 5-bromo-4-fluoro-1-methyl-1H-pyrazole

5-bromo-4-fluoro-1-methyl-1H-pyrazole

CAS No.:
1935264-08-6
Catalog Number:
AG01B85R
Molecular Formula:
C4H4BrFN2
Molecular Weight:
178.9904
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Product Description
Catalog Number:
AG01B85R
Chemical Name:
5-bromo-4-fluoro-1-methyl-1H-pyrazole
CAS Number:
1935264-08-6
Molecular Formula:
C4H4BrFN2
Molecular Weight:
178.9904
MDL Number:
MFCD31615467
IUPAC Name:
5-bromo-4-fluoro-1-methylpyrazole
InChI:
InChI=1S/C4H4BrFN2/c1-8-4(5)3(6)2-7-8/h2H,1H3
InChI Key:
VVHUJWQVOJTUSP-UHFFFAOYSA-N
SMILES:
Cn1ncc(c1Br)F
Properties
Complexity:
90.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.954g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.992g/mol
Monoisotopic Mass:
177.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties