Home Carboxys 4-Bromo-5-methyl-1h-pyrazole-3-carboxylic acid

4-Bromo-5-methyl-1h-pyrazole-3-carboxylic acid

CAS No.:
82231-52-5
Catalog Number:
AG0050CX
Molecular Formula:
C5H5BrN2O2
Molecular Weight:
205.0094
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$44
- +
250mg
95%
In Stock USA
United States
$82
- +
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG0050CX
Chemical Name:
4-Bromo-5-methyl-1h-pyrazole-3-carboxylic acid
CAS Number:
82231-52-5
Molecular Formula:
C5H5BrN2O2
Molecular Weight:
205.0094
MDL Number:
MFCD08056671
IUPAC Name:
4-bromo-5-methyl-1H-pyrazole-3-carboxylic acid
InChI:
InChI=1S/C5H5BrN2O2/c1-2-3(6)4(5(9)10)8-7-2/h1H3,(H,7,8)(H,9,10)
InChI Key:
XIZPNSLYWMMPNI-UHFFFAOYSA-N
SMILES:
OC(=O)c1n[nH]c(c1Br)C
NSC Number:
215265
Properties
Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.953g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
205.011g/mol
Monoisotopic Mass:
203.953g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties