Home Halogens 1-(4-bromo-2-chlorophenyl)-1H-pyrazole

1-(4-bromo-2-chlorophenyl)-1H-pyrazole

CAS No.:
1784581-61-8
Catalog Number:
AG01DYY5
Molecular Formula:
C9H6BrClN2
Molecular Weight:
257.5143
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Product Description
Catalog Number:
AG01DYY5
Chemical Name:
1-(4-bromo-2-chlorophenyl)-1H-pyrazole
CAS Number:
1784581-61-8
Molecular Formula:
C9H6BrClN2
Molecular Weight:
257.5143
MDL Number:
MFCD30237947
IUPAC Name:
1-(4-bromo-2-chlorophenyl)pyrazole
InChI:
InChI=1S/C9H6BrClN2/c10-7-2-3-9(8(11)6-7)13-5-1-4-12-13/h1-6H
InChI Key:
STJCENWHPSVKDV-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)Cl)n1cccn1
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.94g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.515g/mol
Monoisotopic Mass:
255.94g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties