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56921-01-8,MFCD18642553
Catalog No.:AA00IA2R

56921-01-8 | Methyl 5-methyl-4-nitrothiophene-2-carboxylate

Pack Size
Purity
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Price(USD)
Quantity
  
100mg
96%
1 week  
$53.00   $37.00
- +
250mg
96%
1 week  
$79.00   $55.00
- +
1g
96%
1 week  
$97.00   $68.00
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5g
96%
1 week  
$481.00   $337.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00IA2R
Chemical Name:
Methyl 5-methyl-4-nitrothiophene-2-carboxylate
CAS Number:
56921-01-8
Molecular Formula:
C7H7NO4S
Molecular Weight:
201.1998
MDL Number:
MFCD18642553
SMILES:
COC(=O)c1sc(c(c1)[N+](=O)[O-])C
NSC Number:
108993
Properties
Properties
 
BP:
328.3°C at 760 mmHg  
Form:
Solid  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
227  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
2  
XLogP3:
2  

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,2014,vol.57,p.7577-7589

[2]Patent:EP1688420,2006,A1.Locationinpatent:Page/Pagecolumn131

[3]Patent:US2006/167246,2006,A1.Locationinpatent:Page/Pagecolumn155;161

[4]RecueildesTravauxChimiquesdesPays-Bas,1933,vol.52,p.538,547

[5]Patent:WO2011/79804,2011,A1.Locationinpatent:Page/Pagecolumn29

[6]Patent:US2012/245178,2012,A1.Locationinpatent:Page/Pagecolumn16

[7]Patent:WO2015/8234,2015,A1.Locationinpatent:Page/Pagecolumn33;34

[8]Patent:WO2017/35360,2017,A1.Locationinpatent:Paragraph0511

[9]Patent:WO2017/35349,2017,A1.Locationinpatent:Paragraph0588

[1]Patent:WO2005/23819,2005,A1.Locationinpatent:Page/Pagecolumn31

[2]Synthesis,1973,p.313-315

[3]RecueildesTravauxChimiquesdesPays-Bas,1933,vol.52,p.538,547

[1]JournaloftheChemicalSociety.PerkintransactionsII,1980,p.1331-1335

[1]JournaloftheChemicalSociety.PerkintransactionsII,1980,p.1331-1335

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.4026-4030

Literature
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SDS
Tags:56921-01-8 Molecular Formula|56921-01-8 MDL|56921-01-8 SMILES|56921-01-8 Methyl 5-methyl-4-nitrothiophene-2-carboxylate