Home Carboxys 5-Bromo-1H-pyrazole-3-carboxylic acid

5-Bromo-1H-pyrazole-3-carboxylic acid

CAS No.:
1328893-16-8
Catalog Number:
AG0011BO
Molecular Formula:
C4H3BrN2O2
Molecular Weight:
190.9828
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$73
- +
1g
96%
In Stock USA
United States
$213
- +
5g
96%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG0011BO
Chemical Name:
5-Bromo-1H-pyrazole-3-carboxylic acid
CAS Number:
1328893-16-8
Molecular Formula:
C4H3BrN2O2
Molecular Weight:
190.9828
MDL Number:
MFCD21605341
IUPAC Name:
5-bromo-1H-pyrazole-3-carboxylic acid
InChI:
InChI=1S/C4H3BrN2O2/c5-3-1-2(4(8)9)6-7-3/h1H,(H,6,7)(H,8,9)
InChI Key:
OOKGNGYUNBYGEL-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc([nH]n1)Br
Properties
Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.938g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
190.984g/mol
Monoisotopic Mass:
189.938g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties