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1535-73-5,MFCD00041511
Catalog No.:AA003I7O

1535-73-5 | 3-(Trifluoromethoxy)aniline

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$6.00   $4.00
- +
5g
98%
in stock  
$7.00   $5.00
- +
10g
98%
in stock  
$13.00   $9.00
- +
25g
98%
in stock  
$20.00   $14.00
- +
100g
98%
in stock  
$56.00   $39.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003I7O
Chemical Name:
3-(Trifluoromethoxy)aniline
CAS Number:
1535-73-5
Molecular Formula:
C7H6F3NO
Molecular Weight:
177.1238
MDL Number:
MFCD00041511
SMILES:
Nc1cccc(c1)OC(F)(F)F
Properties
Properties
 
BP:
195.9°C at 760 mmHg  
Form:
Liquid  
Refractive Index:
n20/D 1.466(lit.)  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
148  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.1  

Synonyms
 
  
Upstream Synthesis Route

[1]ACSMedicinalChemistryLetters,2012,vol.3,#5,p.373-377

[1]EuropeanJournalofOrganicChemistry,2008,#17,p.2875-2880

[1]BulletindelaSocieteChimiquedeFrance,1986,#6,p.925-929

[1]BulletindelaSocieteChimiquedeFrance,1986,#6,p.925-929

[1]BulletindelaSocieteChimiquedeFrance,1986,#6,p.925-929

Downstream Synthesis Route
450-96-4   
bis-<(trifluoromethoxy)phenyl>amine 
  1535-73-5 

[1]BulletindelaSocieteChimiquedeFrance,1986,p.925-929

51673-84-8    1535-73-5   
(2,2-Dimethoxy-ethyl)-(3-trifluoromethoxy-phenyl)-amine 

[1]Patent:WO2010/1179,2010,A2.Locationinpatent:Page/Pagecolumn56

[2]JournalofMedicinalChemistry,1998,vol.41,p.1598-1612

[1]Jimonet,Patrick;Audiau,François;Barreau,Michel;Blanchard,Jean-Charles;Boireau,Alain;Bour,Yvette;Coléno,Marie-Annick;Doble,Adam;Doerflinger,Gilles;DoHuu,Claudine;Donat,Marie-Hélène;Duchesne,JeanMarie;Ganil,Pierre;Guérémy,Claude;Honoré,Eliane;Just,Bernard;Kerphirique,Roselyne;Gontier,Sylvie;Hubert,Philippe;Laduron,PierreM.;Blevec,JosephLe;Meunier,Mireille;Miquet,Jean-Marie;Nemecek,Conception;Pasquet,Martine;Piot,Odile;Pratt,Jeremy;Rataud,Jean;Reibaud,Michel;Stutzmann,Jean-Marie;Mignani,Serge[JournalofMedicinalChemistry,1999,vol.42,#15,p.2828-2843]

1535-73-5    126067-60-5   
5-methyl-1-(3-trifluoromethyl-phenyl)-1<i>H</i>-pyrazole-3-carboxylicacid(3-trifluoromethoxy-phenyl)-amide 

[1]Kordik,CherylP.;Luo,Chi;Zanoni,BrianC.;Lovenberg,TimothyW.;Wilson,SandyJ.;Vaidya,AnilH.;Crooke,JeffreyJ.;Rosenthal,DanielI.;Reitz,AllenB.[BioorganicandMedicinalChemistryLetters,2001,vol.11,#17,p.2287-2290]

14109-72-9    1535-73-5   
2-methyl-4-(trifluoromethoxy)-1H-indole 
  57330-49-1 

[1]Liu,Kun;Black,ReginaM.;ActonIII,JohnJ.;Mosley,Ralph;Debenham,Sheryl;Abola,Ramon;Yang,Meng;Tschirret-Guth,Richard;Colwell,Lawrence;Liu,Cherrie;Wu,Margaret;Wang,ChuanlinF.;MacNaul,KarenL.;McCann,MargaretE.;Moller,DavidE.;Berger,JoelP.;Meinke,PeterT.;Jones,A.Brian;Wood,HaroldB.[BioorganicandMedicinalChemistryLetters,2005,vol.15,#10,p.2437-2440]

[2]Locationinpatent:experimentalpartActonIII,JohnJ.;Akiyama,TaroE.;Chang,ChingH.;Colwell,Lawrence;Debenham,Sheryl;Doebber,Thomas;Einstein,Monica;Liu,Kun;McCann,MargaretE.;Moller,DavidE.;Muise,EricS.;Tan,Yugen;Thompson,JohnR.;Wong,KennyK.;Wu,Margaret;Xu,Libo;Meinke,PeterT.;Berger,JoelP.;Wood,HaroldB.[JournalofMedicinalChemistry,2009,vol.52,#13,p.3846-3854]

Literature

Title: Triarylmethanes, a new class of cx50 inhibitors.

Journal: Frontiers in pharmacology 20120101

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SDS
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Tags:1535-73-5 Molecular Formula|1535-73-5 MDL|1535-73-5 SMILES|1535-73-5 3-(Trifluoromethoxy)aniline
Catalog No.: AA003I7O
1535-73-5,MFCD00041511
1535-73-5 | 3-(Trifluoromethoxy)aniline
Pack Size： 1g
Purity： 98%
in stock
$6.00 $4.00
Pack Size： 5g
Purity： 98%
in stock
$7.00 $5.00
Pack Size： 10g
Purity： 98%
in stock
$13.00 $9.00
Pack Size： 25g
Purity： 98%
in stock
$20.00 $14.00
Pack Size： 100g
Purity： 98%
in stock
$56.00 $39.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003I7O
Chemical Name: 3-(Trifluoromethoxy)aniline
CAS Number: 1535-73-5
Molecular Formula: C7H6F3NO
Molecular Weight: 177.1238
MDL Number: MFCD00041511
SMILES: Nc1cccc(c1)OC(F)(F)F
Properties
BP: 195.9°C at 760 mmHg  
Form: Liquid  
Refractive Index: n20/D 1.466(lit.)  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 148  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.1  
82:   
Upstream Synthesis Route
914636-35-4    1535-73-5 

[1]ACSMedicinalChemistryLetters,2012,vol.3,#5,p.373-377

39065-91-3    1535-73-5 

[1]EuropeanJournalofOrganicChemistry,2008,#17,p.2875-2880

95-57-8    1535-73-5 

[1]BulletindelaSocieteChimiquedeFrance,1986,#6,p.925-929

766-51-8    1535-73-5 

[1]BulletindelaSocieteChimiquedeFrance,1986,#6,p.925-929

97608-46-3    1535-73-5 

[1]BulletindelaSocieteChimiquedeFrance,1986,#6,p.925-929

Downstream Synthesis Route
450-96-4   
bis-<(trifluoromethoxy)phenyl>amine 
  1535-73-5 

[1]BulletindelaSocieteChimiquedeFrance,1986,p.925-929

51673-84-8    1535-73-5   
(2,2-Dimethoxy-ethyl)-(3-trifluoromethoxy-phenyl)-amine 

[1]Patent:WO2010/1179,2010,A2.Locationinpatent:Page/Pagecolumn56

[2]JournalofMedicinalChemistry,1998,vol.41,p.1598-1612

1147550-11-5    1535-73-5    235101-42-5 

[1]Jimonet,Patrick;Audiau,François;Barreau,Michel;Blanchard,Jean-Charles;Boireau,Alain;Bour,Yvette;Coléno,Marie-Annick;Doble,Adam;Doerflinger,Gilles;DoHuu,Claudine;Donat,Marie-Hélène;Duchesne,JeanMarie;Ganil,Pierre;Guérémy,Claude;Honoré,Eliane;Just,Bernard;Kerphirique,Roselyne;Gontier,Sylvie;Hubert,Philippe;Laduron,PierreM.;Blevec,JosephLe;Meunier,Mireille;Miquet,Jean-Marie;Nemecek,Conception;Pasquet,Martine;Piot,Odile;Pratt,Jeremy;Rataud,Jean;Reibaud,Michel;Stutzmann,Jean-Marie;Mignani,Serge[JournalofMedicinalChemistry,1999,vol.42,#15,p.2828-2843]

1535-73-5    126067-60-5   
5-methyl-1-(3-trifluoromethyl-phenyl)-1<i>H</i>-pyrazole-3-carboxylicacid(3-trifluoromethoxy-phenyl)-amide 

[1]Kordik,CherylP.;Luo,Chi;Zanoni,BrianC.;Lovenberg,TimothyW.;Wilson,SandyJ.;Vaidya,AnilH.;Crooke,JeffreyJ.;Rosenthal,DanielI.;Reitz,AllenB.[BioorganicandMedicinalChemistryLetters,2001,vol.11,#17,p.2287-2290]

14109-72-9    1535-73-5   
2-methyl-4-(trifluoromethoxy)-1H-indole 
  57330-49-1 

[1]Liu,Kun;Black,ReginaM.;ActonIII,JohnJ.;Mosley,Ralph;Debenham,Sheryl;Abola,Ramon;Yang,Meng;Tschirret-Guth,Richard;Colwell,Lawrence;Liu,Cherrie;Wu,Margaret;Wang,ChuanlinF.;MacNaul,KarenL.;McCann,MargaretE.;Moller,DavidE.;Berger,JoelP.;Meinke,PeterT.;Jones,A.Brian;Wood,HaroldB.[BioorganicandMedicinalChemistryLetters,2005,vol.15,#10,p.2437-2440]

[2]Locationinpatent:experimentalpartActonIII,JohnJ.;Akiyama,TaroE.;Chang,ChingH.;Colwell,Lawrence;Debenham,Sheryl;Doebber,Thomas;Einstein,Monica;Liu,Kun;McCann,MargaretE.;Moller,DavidE.;Muise,EricS.;Tan,Yugen;Thompson,JohnR.;Wong,KennyK.;Wu,Margaret;Xu,Libo;Meinke,PeterT.;Berger,JoelP.;Wood,HaroldB.[JournalofMedicinalChemistry,2009,vol.52,#13,p.3846-3854]

Literature fold

Title: Triarylmethanes, a new class of cx50 inhibitors.

Journal: Frontiers in pharmacology20120101

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