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111468-91-8,MFCD03001293
Catalog No.:AA007AHA

111468-91-8 | 1-(5-(2,2,2-Trichloroacetyl)-1H-pyrrol-3-yl)butan-1-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>95%
1 week  
$299.00   $209.00
- +
5mg
>95%
1 week  
$319.00   $223.00
- +
10mg
>95%
1 week  
$358.00   $250.00
- +
500mg
>95%
1 week  
$589.00   $412.00
- +
1g
>95%
1 week  
$813.00   $569.00
- +
5g
>95%
1 week  
$2,907.00   $2,035.00
- +
10g
>95%
1 week  
$5,001.00   $3,501.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA007AHA
Chemical Name:
1-(5-(2,2,2-Trichloroacetyl)-1H-pyrrol-3-yl)butan-1-one
CAS Number:
111468-91-8
Molecular Formula:
C10H10Cl3NO2
Molecular Weight:
282.5509
MDL Number:
MFCD03001293
SMILES:
CCCC(=O)c1c[nH]c(c1)C(=O)C(Cl)(Cl)Cl
Properties
Computed Properties
 
Complexity:
288  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.1  

Downstream Synthesis Route

[1]Garrido,DanielO.A.;Buldain,Graciela;Ojea,MariaI.;Frydman,Benjamin[JournalofOrganicChemistry,1988,vol.53,#2,p.403-407]

[1]Garrido,DanielO.A.;Buldain,Graciela;Ojea,MariaI.;Frydman,Benjamin[JournalofOrganicChemistry,1988,vol.53,#2,p.403-407]

35302-72-8    141-75-3    111468-91-8   
5-butyryl-2-trichloroacetylpyrrole 

[1]Tani;Ariyasu;Nishiyama;Hagiwara;Watanabe;Yokoyama;Murakami[ChemicalandPharmaceuticalBulletin,1996,vol.44,#1,p.48-54]

Literature
Quotation Request
Company Name:
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Contact Person:
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Email:
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Quantity Required:
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Additional Info:
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SDS
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Tags:111468-91-8 Molecular Formula|111468-91-8 MDL|111468-91-8 SMILES|111468-91-8 1-(5-(2,2,2-Trichloroacetyl)-1H-pyrrol-3-yl)butan-1-one
Catalog No.: AA007AHA
111468-91-8,MFCD03001293
111468-91-8 | 1-(5-(2,2,2-Trichloroacetyl)-1H-pyrrol-3-yl)butan-1-one
Pack Size： 1mg
Purity： >95%
1 week
$299.00 $209.00
Pack Size： 5mg
Purity： >95%
1 week
$319.00 $223.00
Pack Size： 10mg
Purity： >95%
1 week
$358.00 $250.00
Pack Size： 500mg
Purity： >95%
1 week
$589.00 $412.00
Pack Size： 1g
Purity： >95%
1 week
$813.00 $569.00
Pack Size： 5g
Purity： >95%
1 week
$2,907.00 $2,035.00
Pack Size： 10g
Purity： >95%
1 week
$5,001.00 $3,501.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA007AHA
Chemical Name: 1-(5-(2,2,2-Trichloroacetyl)-1H-pyrrol-3-yl)butan-1-one
CAS Number: 111468-91-8
Molecular Formula: C10H10Cl3NO2
Molecular Weight: 282.5509
MDL Number: MFCD03001293
SMILES: CCCC(=O)c1c[nH]c(c1)C(=O)C(Cl)(Cl)Cl
Properties
Complexity: 288  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.1  
Downstream Synthesis Route
35302-72-8    141-75-3    111468-91-8 

[1]Garrido,DanielO.A.;Buldain,Graciela;Ojea,MariaI.;Frydman,Benjamin[JournalofOrganicChemistry,1988,vol.53,#2,p.403-407]

111468-91-8    111468-95-2 

[1]Garrido,DanielO.A.;Buldain,Graciela;Ojea,MariaI.;Frydman,Benjamin[JournalofOrganicChemistry,1988,vol.53,#2,p.403-407]

35302-72-8    141-75-3    111468-91-8   
5-butyryl-2-trichloroacetylpyrrole 

[1]Tani;Ariyasu;Nishiyama;Hagiwara;Watanabe;Yokoyama;Murakami[ChemicalandPharmaceuticalBulletin,1996,vol.44,#1,p.48-54]

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