104395-39-3,MFCD12789706
Catalog No.:AA008W9U

104395-39-3 | 2,2,2-Trifluoro-1-(4-methoxyphenyl)ethyl Bromide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$188.00   $132.00
- +
1g
95%
in stock  
$410.00   $287.00
- +
5g
95%
in stock  
$1,442.00   $1,009.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA008W9U
Chemical Name:
2,2,2-Trifluoro-1-(4-methoxyphenyl)ethyl Bromide
CAS Number:
104395-39-3
Molecular Formula:
C9H8BrF3O
Molecular Weight:
269.0584
MDL Number:
MFCD12789706
SMILES:
COc1ccc(cc1)C(C(F)(F)F)Br
Properties
Computed Properties
 
Complexity:
175  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.6  

Downstream Synthesis Route

[1]Richard,JohnP.;Yeary,PaulE.[JournaloftheAmericanChemicalSociety,1993,vol.115,#5,p.1739-1744]

104395-39-3   
CASUnavailable 
  1737-27-5   
CASUnavailable 
  122425-26-7 

[1]Richard,JohnP.[JournaloftheAmericanChemicalSociety,1989,vol.111,#17,p.6735-6744]

[1]Varenikov,Andrii;Shapiro,Evgeny;Gandelman,Mark[OrganicLetters,2020,vol.22,#23,p.9386-9391]

[2]Okano,Takashi;Sugiura,Hirokazu;Fumoto,Masataka;Matsubara,Hiroyoshi;Kusukawa,Takahiro;Fujita,Makoto[JournalofFluorineChemistry,2002,vol.114,#1,p.91-98]

[3]Gu,Yucheng;Hu,Jinbo;Kuang,Cuiwen;Ni,Chuanfa;Xie,Qiqiang;Zhou,Xin[OrganicLetters,2020]

[4]Kuang,Cuiwen;Ni,Chuanfa;Gu,Yucheng;Hu,Jinbo[Synthesis,2022,vol.54,#5,p.1272-1286]

Literature
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SDS
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Tags:104395-39-3 Molecular Formula|104395-39-3 MDL|104395-39-3 SMILES|104395-39-3 2,2,2-Trifluoro-1-(4-methoxyphenyl)ethyl Bromide
Catalog No.: AA008W9U
104395-39-3,MFCD12789706
104395-39-3 | 2,2,2-Trifluoro-1-(4-methoxyphenyl)ethyl Bromide
Pack Size: 250mg
Purity: 95%
in stock
$188.00 $132.00
Pack Size: 1g
Purity: 95%
in stock
$410.00 $287.00
Pack Size: 5g
Purity: 95%
in stock
$1,442.00 $1,009.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA008W9U
Chemical Name: 2,2,2-Trifluoro-1-(4-methoxyphenyl)ethyl Bromide
CAS Number: 104395-39-3
Molecular Formula: C9H8BrF3O
Molecular Weight: 269.0584
MDL Number: MFCD12789706
SMILES: COc1ccc(cc1)C(C(F)(F)F)Br
Properties
Complexity: 175  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.6  
Downstream Synthesis Route
104395-39-3    1737-27-5    150935-07-2 

[1]Richard,JohnP.;Yeary,PaulE.[JournaloftheAmericanChemicalSociety,1993,vol.115,#5,p.1739-1744]

104395-39-3   
CASUnavailable 
  1737-27-5   
CASUnavailable 
  122425-26-7 

[1]Richard,JohnP.[JournaloftheAmericanChemicalSociety,1989,vol.111,#17,p.6735-6744]

1737-27-5    104395-39-3 

[1]Varenikov,Andrii;Shapiro,Evgeny;Gandelman,Mark[OrganicLetters,2020,vol.22,#23,p.9386-9391]

[2]Okano,Takashi;Sugiura,Hirokazu;Fumoto,Masataka;Matsubara,Hiroyoshi;Kusukawa,Takahiro;Fujita,Makoto[JournalofFluorineChemistry,2002,vol.114,#1,p.91-98]

[3]Gu,Yucheng;Hu,Jinbo;Kuang,Cuiwen;Ni,Chuanfa;Xie,Qiqiang;Zhou,Xin[OrganicLetters,2020]

[4]Kuang,Cuiwen;Ni,Chuanfa;Gu,Yucheng;Hu,Jinbo[Synthesis,2022,vol.54,#5,p.1272-1286]

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