Home Carboxys 3-(4-Chlorophenyl)-1-methyl-1h-pyrazole-5-carboxylic acid

3-(4-Chlorophenyl)-1-methyl-1h-pyrazole-5-carboxylic acid

CAS No.:
1015868-48-0
Catalog Number:
AG008YE3
Molecular Formula:
C11H9ClN2O2
Molecular Weight:
236.6544
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$190
- +
Product Description
Catalog Number:
AG008YE3
Chemical Name:
3-(4-Chlorophenyl)-1-methyl-1h-pyrazole-5-carboxylic acid
CAS Number:
1015868-48-0
Molecular Formula:
C11H9ClN2O2
Molecular Weight:
236.6544
MDL Number:
MFCD08446011
IUPAC Name:
5-(4-chlorophenyl)-2-methylpyrazole-3-carboxylic acid
InChI:
InChI=1S/C11H9ClN2O2/c1-14-10(11(15)16)6-9(13-14)7-2-4-8(12)5-3-7/h2-6H,1H3,(H,15,16)
InChI Key:
JNOADCITUCNMIN-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1nn(c(c1)C(=O)O)C
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.035g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.655g/mol
Monoisotopic Mass:
236.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties