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CAS Number: 936084-45-6
1-(tert-butyl)-5-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid

Structure

 1-(tert-butyl)-5-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid
Name: 1-(tert-butyl)-5-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid
Synonyms:
General Information
Product Number: 936084456

CAS Registry Number 936084-45-6
Name:
1H-?Pyrazole-?4-?carboxylic acid, 1-?(1,?1-?dimethylethyl)?-?5-?(4-?fluorophenyl)?-
1-tert-Butyl-5-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid
1-tert-Butyl-5-(4-fluorophenyl)pyrazole-4-carboxylic acid

 

Chemical Formula: C14H15FN2O2
Exact Mass: 262.11
Molecular Weight: 262.28
m/z: 262.11 (100.0%), 263.12 (15.4%), 264.12 (1.5%)

 

InChI:InChI=1S/C14H15FN2O2/c1-14(2,3)17-12(11(8-16-17)13(18)19)9-4-6-10(15)7-5-9/h4-8H,1-3H3,(H,18,19)

InChI Key:KFFBNVNQIATQRL-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)N1C(=C(C=N1)C(=O)O)C2=CC=C(C=C2)F

Specification

98%
References

PCT Int. Appl. (2013), WO 2013018695 A1 20130207.                                 

PCT Int. Appl. (2007), WO 2007052843 A1 20070510.                                  
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