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

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

CAS No.:
1784137-82-1
Catalog Number:
AG01BE2N
Molecular Formula:
C5H7BrN2O
Molecular Weight:
191.0259
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Product Description
Catalog Number:
AG01BE2N
Chemical Name:
5-bromo-4-methoxy-1-methyl-1H-pyrazole
CAS Number:
1784137-82-1
Molecular Formula:
C5H7BrN2O
Molecular Weight:
191.0259
MDL Number:
MFCD28063766
IUPAC Name:
5-bromo-4-methoxy-1-methylpyrazole
InChI:
InChI=1S/C5H7BrN2O/c1-8-5(6)4(9-2)3-7-8/h3H,1-2H3
InChI Key:
NJZVAMRAUGUSDR-UHFFFAOYSA-N
SMILES:
COc1cnn(c1Br)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:
189.974g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.028g/mol
Monoisotopic Mass:
189.974g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties