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1015845-77-8,MFCD05864512
Catalog No.:AA0004SI
1015845-77-8 | 1-(2-Methoxyphenyl)-1h-pyrazole-4-carboxylic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$37.00   $26.00
- +
5g
95%
in stock  
$107.00   $75.00
- +
10g
95%
in stock  
$178.00   $125.00
- +
  • Technical Information
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Technical Information
Catalog Number:
AA0004SI
Chemical Name:
1-(2-Methoxyphenyl)-1h-pyrazole-4-carboxylic acid
CAS Number:
1015845-77-8
Molecular Formula:
C11H10N2O3
Molecular Weight:
218.2087
MDL Number:
MFCD05864512
IUPAC Name:
1-(2-methoxyphenyl)pyrazole-4-carboxylic acid
InChI:
InChI=1S/C11H10N2O3/c1-16-10-5-3-2-4-9(10)13-7-8(6-12-13)11(14)15/h2-7H,1H3,(H,14,15)
InChI Key:
GETIPSHEOZTBRP-UHFFFAOYSA-N
SMILES:
COc1ccccc1n1ncc(c1)C(=O)O
Properties
Computed Properties
 
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.069g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.212g/mol
Monoisotopic Mass:
218.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

Synonyms
 
1-(2-Methoxyphenyl)-1H-pyrazole-4-carboxylic acid 
1015845-77-8 
DA-18859 
AM20020086 
FT-0763795 
Y-1927 
1H-Pyrazole-4-carboxylic acid, 1-(2-methoxyphenyl)- 
4004808-25G 
4004808-50G 
1-(2-Methoxyphenyl)-1H-pyrazole-4-carboxylic acid, AldrichCPR 
SCHEMBL10202532 
CTK3J9938 
DTXSID00654289 
ZINC2559666 
ZX-CM002949 
MFCD05864512 
AKOS012334036 
AJ-40313 
Literature
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