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175278-42-9,MFCD00173708
Catalog No.:AA0020RC

175278-42-9 | 5-Nitro-2-(p-tolylthio)benzaldehyde

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>95%
1 week  
$299.00   $209.00
- +
5mg
>95%
1 week  
$319.00   $223.00
- +
500mg
>95%
1 week  
$339.00   $238.00
- +
1g
>95%
1 week  
$414.00   $290.00
- +
5g
>95%
1 week  
$1,112.00   $779.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0020RC
Chemical Name:
5-Nitro-2-(p-tolylthio)benzaldehyde
CAS Number:
175278-42-9
Molecular Formula:
C14H11NO3S
Molecular Weight:
273.3070
MDL Number:
MFCD00173708
SMILES:
O=Cc1cc(ccc1Sc1ccc(cc1)C)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
323  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.6  

Downstream Synthesis Route
175278-42-9   
2-methyl-7-nitro-thioxanthene 
  78160-10-8 

[1]Campbelletal.[JournaloftheChemicalSociety,1941,p.747,749]

[1]Campbelletal.[JournaloftheChemicalSociety,1941,p.747,749]

[1]Loudon,J.D.;Smith,D.M.[JournaloftheChemicalSociety,1964,p.2801-2806]

[1]Loudon,J.D.;Smith,D.M.[JournaloftheChemicalSociety,1964,p.2801-2806]

175278-42-9    108-91-8   
Hydroxy-(5-nitro-2-p-tolylsulfanyl-phenyl)-methyl-phosphonicacid;compoundwithcyclohexylamine 

[1]Beers,ScottA.;Malloy,ElizabethA.;Wu,Wei;Wachter,MichaelP.;Gunnia,Uma;Cavender,Druie;Harris,Crafford;Davis,Janet;Brosius,Ruth;Pellegrino-Gensey,J.Lee;Siekierka,John[BioorganicandMedicinalChemistry,1997,vol.5,#12,p.2203-2211]

Literature
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SDS
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Tags:175278-42-9 Molecular Formula|175278-42-9 MDL|175278-42-9 SMILES|175278-42-9 5-Nitro-2-(p-tolylthio)benzaldehyde
Catalog No.: AA0020RC
175278-42-9,MFCD00173708
175278-42-9 | 5-Nitro-2-(p-tolylthio)benzaldehyde
Pack Size： 1mg
Purity： >95%
1 week
$299.00 $209.00
Pack Size： 5mg
Purity： >95%
1 week
$319.00 $223.00
Pack Size： 500mg
Purity： >95%
1 week
$339.00 $238.00
Pack Size： 1g
Purity： >95%
1 week
$414.00 $290.00
Pack Size： 5g
Purity： >95%
1 week
$1,112.00 $779.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0020RC
Chemical Name: 5-Nitro-2-(p-tolylthio)benzaldehyde
CAS Number: 175278-42-9
Molecular Formula: C14H11NO3S
Molecular Weight: 273.3070
MDL Number: MFCD00173708
SMILES: O=Cc1cc(ccc1Sc1ccc(cc1)C)[N+](=O)[O-]
Properties
Complexity: 323  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 19  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.6  
Downstream Synthesis Route
175278-42-9   
2-methyl-7-nitro-thioxanthene 
  78160-10-8 

[1]Campbelletal.[JournaloftheChemicalSociety,1941,p.747,749]

10486-08-5    6361-21-3    175278-42-9 

[1]Campbelletal.[JournaloftheChemicalSociety,1941,p.747,749]

175278-42-9    92103-44-1 

[1]Loudon,J.D.;Smith,D.M.[JournaloftheChemicalSociety,1964,p.2801-2806]

175278-42-9    108-24-7    94005-79-5 

[1]Loudon,J.D.;Smith,D.M.[JournaloftheChemicalSociety,1964,p.2801-2806]

175278-42-9    108-91-8   
Hydroxy-(5-nitro-2-p-tolylsulfanyl-phenyl)-methyl-phosphonicacid;compoundwithcyclohexylamine 

[1]Beers,ScottA.;Malloy,ElizabethA.;Wu,Wei;Wachter,MichaelP.;Gunnia,Uma;Cavender,Druie;Harris,Crafford;Davis,Janet;Brosius,Ruth;Pellegrino-Gensey,J.Lee;Siekierka,John[BioorganicandMedicinalChemistry,1997,vol.5,#12,p.2203-2211]

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