[email protected] +1 858-523-8231
AA Blocks, Building Blocks, Catalysts, Inhibitors Login | Register
AA Blocks, Building Blocks, Catalysts, Inhibitors
Home Amines 1001665-65-1
1001665-65-1,MFCD09835734
Catalog No.:AA00011S
1001665-65-1 | Ethyl 5-amino-4-cyano-1-(4-fluorophenyl)pyrazole-3-carboxylate
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$28.00   $19.00
- +
1g
98%
in stock  
$57.00   $40.00
- +
5g
98%
in stock  
$169.00   $118.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00011S
Chemical Name:
Ethyl 5-amino-4-cyano-1-(4-fluorophenyl)pyrazole-3-carboxylate
CAS Number:
1001665-65-1
Molecular Formula:
C13H11FN4O2
Molecular Weight:
274.2504
MDL Number:
MFCD09835734
IUPAC Name:
ethyl 5-amino-4-cyano-1-(4-fluorophenyl)pyrazole-3-carboxylate
InChI:
InChI=1S/C13H11FN4O2/c1-2-20-13(19)11-10(7-15)12(16)18(17-11)9-5-3-8(14)4-6-9/h3-6H,2,16H2,1H3
InChI Key:
UUTVXASIJAMACY-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nn(c(c1C#N)N)c1ccc(cc1)F
Properties
Computed Properties
 
Complexity:
402  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.087g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
274.255g/mol
Monoisotopic Mass:
274.087g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
93.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

Synonyms
 
1001665-65-1 
Ethyl 5-amino-4-cyano-1-(4-fluorophenyl)-1H-pyrazole-3-carboxylate 
AKOS015854723 
RTR-000054 
AJ-96062 
CJ-19428 
AX8230606 
TR-000054 
ST24024986 
Z6239 
A-4036 
I05-730 
ETHYL 5-AMINO-4-CYANO-1-(4-FLUOROPHENYL)PYRAZOLE-3-CARBOXYLATE 
1H-Pyrazole-3-carboxylic acid, 5-amino-4-cyano-1-(4-fluorophenyl)-, ethyl ester 
C13H11FN4O2 
Ethyl5-amino-4-cyano-1-(4-fluorophenyl)-1H-pyrazole-3-carboxylate 
ACMC-2097n2 
SCHEMBL13664215 
CTK3J8596 
DTXSID20674868 
ANW-14172 
MFCD09835734 
ZINC38537315 
Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Additional Info:
Submit
Q & A
Related Products
1150163-94-2

1150163-94-2

 1150164-00-3

1150164-00-3

 1150164-68-3

1150164-68-3

 1150163-97-5

1150163-97-5

 1150164-14-9

1150164-14-9

 1001665-65-1

1001665-65-1
Building Blocks
More >