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Home Carboxys 5-(4-Methoxyphenyl)-1-methylpyrazole-3-carboxylic acid

5-(4-Methoxyphenyl)-1-methylpyrazole-3-carboxylic acid

CAS No.:
957312-76-4
Catalog Number:
AG00IJF0
Molecular Formula:
C12H12N2O3
Molecular Weight:
232.2353
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$99
- +
5g
98%
In Stock USA
United States
$300
- +
10g
98%
In Stock USA
United States
$525
- +
25g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00IJF0
Chemical Name:
5-(4-Methoxyphenyl)-1-methylpyrazole-3-carboxylic acid
CAS Number:
957312-76-4
Molecular Formula:
C12H12N2O3
Molecular Weight:
232.2353
MDL Number:
MFCD07186421
IUPAC Name:
5-(4-methoxyphenyl)-1-methylpyrazole-3-carboxylic acid
InChI:
InChI=1S/C12H12N2O3/c1-14-11(7-10(13-14)12(15)16)8-3-5-9(17-2)6-4-8/h3-7H,1-2H3,(H,15,16)
InChI Key:
SMMCMCIJHBQWLN-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1cc(nn1C)C(=O)O
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.085g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
232.239g/mol
Monoisotopic Mass:
232.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties