Home Fluorides 114152-21-5
114152-21-5,MFCD00061219
Catalog No.:AA000ALH

114152-21-5 | 2-(2,3,6-Trifluorophenyl)acetonitrile

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Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$38.00   $27.00
- +
5g
97%
in stock  
$146.00   $103.00
- +
25g
≥98%
in stock  
$550.00   $385.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
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Technical Information
Catalog Number:
AA000ALH
Chemical Name:
2-(2,3,6-Trifluorophenyl)acetonitrile
CAS Number:
114152-21-5
Molecular Formula:
C8H4F3N
Molecular Weight:
171.1193
MDL Number:
MFCD00061219
SMILES:
N#CCc1c(F)ccc(c1F)F
Properties
Computed Properties
 
Complexity:
198  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
1  
XLogP3:
1.9  

Downstream Synthesis Route
2,3,6-trifluorobenzylchloride 
  7430-15-1    114152-21-5 

[1]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-US4880806,1989,ACurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-US4874764,1989,A

[2]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-US4855292,1989,A

114152-21-5   
ethyl2-(2,3,6-trifluorophenyl)acetate 

[1]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-US4874764,1989,A

[2]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-US4880806,1989,A

[3]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-US4855292,1989,A

[1]Mandal,Mihirbaran;Wu,Yusheng;Misiaszek,Jeffrey;Li,Guoqing;Buevich,Alexei;Caldwell,JohnP.;Liu,Xiaoxiang;Mazzola,RobertD.;Orth,Peter;Strickland,Corey;Voigt,Johannes;Wang,Hongwu;Zhu,Zhaoning;Chen,Xia;Grzelak,Michael;Hyde,LynnA.;Kuvelkar,Reshma;Leach,PrescottT.;Terracina,Giuseppe;Zhang,Lili;Zhang,Qi;Michener,MariaS.;Smith,Brad;Cox,Kathleen;Grotz,Diane;Favreau,Leonard;Mitra,Kaushik;Kazakevich,Irina;McKittrick,BrianA.;Greenlee,William;Kennedy,MatthewE.;Parker,EricM.;Cumming,JaredN.;Stamford,AndrewW.[JournalofMedicinalChemistry,2016,vol.59,#7,p.3231-3248]

[1]Mandal,Mihirbaran;Wu,Yusheng;Misiaszek,Jeffrey;Li,Guoqing;Buevich,Alexei;Caldwell,JohnP.;Liu,Xiaoxiang;Mazzola,RobertD.;Orth,Peter;Strickland,Corey;Voigt,Johannes;Wang,Hongwu;Zhu,Zhaoning;Chen,Xia;Grzelak,Michael;Hyde,LynnA.;Kuvelkar,Reshma;Leach,PrescottT.;Terracina,Giuseppe;Zhang,Lili;Zhang,Qi;Michener,MariaS.;Smith,Brad;Cox,Kathleen;Grotz,Diane;Favreau,Leonard;Mitra,Kaushik;Kazakevich,Irina;McKittrick,BrianA.;Greenlee,William;Kennedy,MatthewE.;Parker,EricM.;Cumming,JaredN.;Stamford,AndrewW.[JournalofMedicinalChemistry,2016,vol.59,#7,p.3231-3248]

114152-21-5   
C10H5F3O4 

[1]Mandal,Mihirbaran;Wu,Yusheng;Misiaszek,Jeffrey;Li,Guoqing;Buevich,Alexei;Caldwell,JohnP.;Liu,Xiaoxiang;Mazzola,RobertD.;Orth,Peter;Strickland,Corey;Voigt,Johannes;Wang,Hongwu;Zhu,Zhaoning;Chen,Xia;Grzelak,Michael;Hyde,LynnA.;Kuvelkar,Reshma;Leach,PrescottT.;Terracina,Giuseppe;Zhang,Lili;Zhang,Qi;Michener,MariaS.;Smith,Brad;Cox,Kathleen;Grotz,Diane;Favreau,Leonard;Mitra,Kaushik;Kazakevich,Irina;McKittrick,BrianA.;Greenlee,William;Kennedy,MatthewE.;Parker,EricM.;Cumming,JaredN.;Stamford,AndrewW.[JournalofMedicinalChemistry,2016,vol.59,#7,p.3231-3248]

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Tags:114152-21-5 Molecular Formula|114152-21-5 MDL|114152-21-5 SMILES|114152-21-5 2-(2,3,6-Trifluorophenyl)acetonitrile