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Home Fluorides 168833-80-5
168833-80-5,MFCD00066337
Catalog No.:AA003B7O

168833-80-5 | 3-(Trifluoromethoxy)cinnamic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$23.00   $16.00
- +
5g
98%
in stock  
$48.00   $34.00
- +
25g
98%
in stock  
$106.00   $75.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003B7O
Chemical Name:
3-(Trifluoromethoxy)cinnamic acid
CAS Number:
168833-80-5
Molecular Formula:
C10H7F3O3
Molecular Weight:
232.1560
MDL Number:
MFCD00066337
SMILES:
OC(=O)C=Cc1cccc(c1)OC(F)(F)F
Properties
Properties
 
Form:
Solid  
Storage:
Room Temperature;Keep in dry area;  

Computed Properties
 
Complexity:
273  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
3.3  

Downstream Synthesis Route

[1]CurrentPatentAssignee:GruenenthalPharmaGmbH&Co.Kommanditgesellschaft-WO2005/123681,2005,A1Locationinpatent:Page/Pagecolumn33

168833-80-5   
caudatin 
 
3-O-(3-trifluoromethoxy)cinnamoylcaudatin 

[1]Locationinpatent:experimentalpartWang,Li-Jun;Geng,Chang-An;Ma,Yun-Bao;Luo,Jie;Huang,Xiao-Yan;Chen,Hao;Zhou,Ning-Jia;Zhang,Xue-Mei;Chen,Ji-Jun[EuropeanJournalofMedicinalChemistry,2012,vol.54,p.352-365]

168833-80-5    548-93-6   
N-(3-trifluoromethoxycinnamoyl)-3-hydroxyanthranilicacid 

[1]Eudes,Aymerick;Benites,VeronicaTeixeira;Wang,George;Baidoo,EdwardE.K.;Lee,TaekSoon;Keasling,JayD.;Loqué,Dominique[PLoSONE,2015,vol.10,#10]

168833-80-5    4389-45-1   
N-(3-trifluoromethoxycinnamoyl)-3-methylanthranilicacid 

[1]Eudes,Aymerick;Benites,VeronicaTeixeira;Wang,George;Baidoo,EdwardE.K.;Lee,TaekSoon;Keasling,JayD.;Loqué,Dominique[PLoSONE,2015,vol.10,#10]

168833-80-5    6388-47-2   
N-(3-trifluoromethoxycinnamoyl)-3-chloroanthranilicacid 

[1]PLoSONE,2015,vol.10

Literature
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SDS
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