Home Halogens 3-bromo-4-(chloromethyl)-1-methyl-1H-pyrazole

3-bromo-4-(chloromethyl)-1-methyl-1H-pyrazole

CAS No.:
2060043-12-9
Catalog Number:
AG01BS29
Molecular Formula:
C5H6BrClN2
Molecular Weight:
209.4715
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Product Description
Catalog Number:
AG01BS29
Chemical Name:
3-bromo-4-(chloromethyl)-1-methyl-1H-pyrazole
CAS Number:
2060043-12-9
Molecular Formula:
C5H6BrClN2
Molecular Weight:
209.4715
MDL Number:
MFCD30536015
IUPAC Name:
3-bromo-4-(chloromethyl)-1-methylpyrazole
InChI:
InChI=1S/C5H6BrClN2/c1-9-3-4(2-7)5(6)8-9/h3H,2H2,1H3
InChI Key:
VMXMDGNXBKSYFQ-UHFFFAOYSA-N
SMILES:
ClCc1cn(nc1Br)C
Properties
Complexity:
101  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.94g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.471g/mol
Monoisotopic Mass:
207.94g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties