Home Halogens 1-(4-bromo-1H-pyrazol-1-yl)propan-2-one

1-(4-bromo-1H-pyrazol-1-yl)propan-2-one

CAS No.:
898054-56-3
Catalog Number:
AG019S36
Molecular Formula:
C6H7BrN2O
Molecular Weight:
203.0366
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
50mg
95%
In Stock USA
United States
$63
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Product Description
Catalog Number:
AG019S36
Chemical Name:
1-(4-bromo-1H-pyrazol-1-yl)propan-2-one
CAS Number:
898054-56-3
Molecular Formula:
C6H7BrN2O
Molecular Weight:
203.0366
MDL Number:
MFCD04970175
IUPAC Name:
1-(4-bromopyrazol-1-yl)propan-2-one
InChI:
InChI=1S/C6H7BrN2O/c1-5(10)3-9-4-6(7)2-8-9/h2,4H,3H2,1H3
InChI Key:
OMJZQGSHLIJGAR-UHFFFAOYSA-N
SMILES:
CC(=O)Cn1cc(cn1)Br
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.974g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.039g/mol
Monoisotopic Mass:
201.974g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties