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

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

CAS No.:
929554-40-5
Catalog Number:
AG00H11D
Molecular Formula:
C5H5BrN2O2
Molecular Weight:
205.0094
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95+%
1 week
United States
$320
- +
Product Description
Catalog Number:
AG00H11D
Chemical Name:
3-Bromo-4-methyl-1H-pyrazole-5-carboxylic acid
CAS Number:
929554-40-5
Molecular Formula:
C5H5BrN2O2
Molecular Weight:
205.0094
MDL Number:
MFCD22030963
IUPAC Name:
5-bromo-4-methyl-1H-pyrazole-3-carboxylic acid
InChI:
InChI=1S/C5H5BrN2O2/c1-2-3(5(9)10)7-8-4(2)6/h1H3,(H,7,8)(H,9,10)
InChI Key:
CUBJTYQPUOFEIA-UHFFFAOYSA-N
SMILES:
OC(=O)c1n[nH]c(c1C)Br
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:
1.5  
Properties