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10250-63-2,MFCD03933288
Catalog No.:AA0007IL
10250-63-2 | Ethyl 1-Methyl-3-phenylpyrazole-5-carboxylate
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$100.00   $70.00
- +
5g
98%
in stock  
$349.00   $245.00
- +
10g
98%
in stock  
$603.00   $422.00
- +
  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA0007IL
Chemical Name:
Ethyl 1-Methyl-3-phenylpyrazole-5-carboxylate
CAS Number:
10250-63-2
Molecular Formula:
C13H14N2O2
Molecular Weight:
230.2625
MDL Number:
MFCD03933288
IUPAC Name:
ethyl 2-methyl-5-phenylpyrazole-3-carboxylate
InChI:
InChI=1S/C13H14N2O2/c1-3-17-13(16)12-9-11(14-15(12)2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
InChI Key:
JDJQHVJXMXXKFO-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(nn1C)c1ccccc1
Properties
Computed Properties
 
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.106g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.267g/mol
Monoisotopic Mass:
230.106g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Synonyms
 
Ethyl 1-methyl-3-phenyl-1H-pyrazole-5-carboxylate 
10250-63-2 
ZINC2520656 
MFCD03933288 
SBB097608 
AKOS015908904 
CS-W000420 
MCULE-3430535559 
AJ-37122 
AK-56634 
CJ-08762 
DS-15120 
ethyl 2-methyl-5-phenylpyrazole-3-carboxylate 
DB-058818 
FT-0740025 
ST24046743 
K-0310 
5-(Ethoxycarbonyl)-1-methyl-3-phenyl-1H-pyrazole 
ethyl 1-methyl-3-phenyl-1H-5-pyrazolecarboxylate 
I14-34544 
1-[5-(Ethoxycarbonyl)-1-methyl-1H-pyrazol-3-yl]benzene 
1-Methyl-3-phenyl-1H-pyrazole-5-carboxylic acid ethyl ester 
1H-Pyrazole-5-carboxylicacid, 1-methyl-3-phenyl-, ethyl ester 
ethyl 1-methyl-3-phenylpyrazole-5-carboxylate 
1H-Pyrazole-5-carboxylicacid,1-methyl-3-phenyl-,ethyl ester 
2-Methyl-5-phenyl-2H-pyrazole-3-carboxylic acid ethyl ester 
1H-Pyrazole-5-carboxylic acid, 1-methyl-3-phenyl-, ethyl ester 
ZINC02520656 
CID4166529 
AC1N55VW 
SCHEMBL3664984 
CTK4A1151 
DTXSID60400163 
JDJQHVJXMXXKFO-UHFFFAOYSA-N 
KS-00000G5M 
Literature
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