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Home Fluorides 115029-24-8
115029-24-8,MFCD00010322
Catalog No.:AA000FO5

115029-24-8 | 2-Fluoro-4-(trifluoromethyl)benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$12.00   $8.00
- +
5g
98%
in stock  
$26.00   $18.00
- +
10g
98%
in stock  
$32.00   $22.00
- +
25g
98%
in stock  
$71.00   $50.00
- +
100g
98%
in stock  
$267.00   $187.00
- +
500g
98%
in stock  
$1,331.00   $932.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000FO5
Chemical Name:
2-Fluoro-4-(trifluoromethyl)benzoic acid
CAS Number:
115029-24-8
Molecular Formula:
C8H4F4O2
Molecular Weight:
208.1098
MDL Number:
MFCD00010322
SMILES:
OC(=O)c1ccc(cc1F)C(F)(F)F
Properties
Properties
 
BP:
231.4 °C at 760 mmHg  
Form:
Solid  
MP:
168-170 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
226  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
3.4  

Upstream Synthesis Route

[1]Patent:US2013/281710,2013,A1,.Locationinpatent:Paragraph0268;269;270

[1]Patent:CN106083563,2016,A,.Locationinpatent:Paragraph0011

Downstream Synthesis Route
115029-24-8   
2-fluoro-4-(trifluoromethyl)benzoicacidhydrazide 

[1]JournalofMedicinalChemistry,2007,vol.50,p.528-542

115029-24-8   
2-{4-3-(aminomethyl)-4-fluorophenoxy-2-methylphenoxy}-2-methylpropanoicacidester 
 
2-(4-{4-fluoro-3-(2-fluoro-4-trifluoromethyl-benzoylamino)-methyl-phenoxy}-2-methyl-phenoxy)-2-methyl-propionicacid 

[1]BioorganicandMedicinalChemistryLetters,2007,vol.17,p.6744-6749

115029-24-8   
2-{4-3-(aminomethyl)-4-methylphenoxy-2-methylphenoxy}-2-methylpropanoicacidester 
 
2-(4-{3-(2-fluoro-4-trifluoromethyl-benzoylamino)-methyl-4-methyl-phenoxy}-2-methyl-phenoxy)-2-methyl-propionicacid 

[1]BioorganicandMedicinalChemistryLetters,2007,vol.17,p.6744-6749

115029-24-8   
2-{4-3-(aminomethyl)-5-fluorophenoxy-2-methylphenoxy}-2-methylpropanoicacidester 
 
2-(4-{3-fluoro-5-(2-fluoro-4-trifluoromethyl-benzoylamino)-methyl-phenoxy}-2-methyl-phenoxy)-2-methyl-propionicacid 

[1]BioorganicandMedicinalChemistryLetters,2007,vol.17,p.6744-6749

115029-24-8   
2-{4-3-(aminomethyl)-5-methylphenoxy-2-methylphenoxy}-2-methylpropanoicacidester 
 
2-(4-{3-(2-fluoro-4-trifluoromethyl-benzoylamino)-methyl-5-methyl-phenoxy}-2-methyl-phenoxy)-2-methyl-propionicacid 

[1]BioorganicandMedicinalChemistryLetters,2007,vol.17,p.6744-6749

Literature
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SDS
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Tags:115029-24-8 Molecular Formula|115029-24-8 MDL|115029-24-8 SMILES|115029-24-8 2-Fluoro-4-(trifluoromethyl)benzoic acid |Halogenated_Heterocycles