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67974-08-7,MFCD00631285
Catalog No.:AA00FBBO

67974-08-7 | tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$30.00   $21.00
- +
1g
95%
in stock  
$50.00   $35.00
- +
5g
95%
in stock  
$122.00   $85.00
- +
25g
95%
in stock  
$436.00   $305.00
- +
100g
95%
in stock  
$1,579.00   $1,105.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00FBBO
Chemical Name:
tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate
CAS Number:
67974-08-7
Molecular Formula:
C10H14N2O4
Molecular Weight:
226.2292
MDL Number:
MFCD00631285
SMILES:
O=C(c1cc(cn1C)[N+](=O)[O-])OC(C)(C)C
Properties
Computed Properties
 
Complexity:
292  
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:
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:
1.7  

Downstream Synthesis Route

[1]Wurtz,NicholasR.;Turner,JamesM.;Baird,EldonE.;Dervan,PeterB.[OrganicLetters,2001,vol.3,#8,p.1201-1203]

[2]CurrentPatentAssignee:SHANGHAIMUSEHEALTHTECH-CN109970617,2019,ALocationinpatent:Paragraph0072;0109-0113

[1]Wurtz,NicholasR.;Turner,JamesM.;Baird,EldonE.;Dervan,PeterB.[OrganicLetters,2001,vol.3,#8,p.1201-1203]

[2]CurrentPatentAssignee:SHANGHAIMUSEHEALTHTECH-CN109970617,2019,A

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2011/130398,2011,A1Locationinpatent:Page/Pagecolumn82

Literature
Quotation Request
Company Name:
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Contact Person:
*
Email:
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Quantity Required:
*
Country:
Additional Info:
Submit
SDS
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Tags:67974-08-7 Molecular Formula|67974-08-7 MDL|67974-08-7 SMILES|67974-08-7 tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate
Catalog No.: AA00FBBO
67974-08-7,MFCD00631285
67974-08-7 | tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate
Pack Size： 250mg
Purity： 95%
in stock
$30.00 $21.00
Pack Size： 1g
Purity： 95%
in stock
$50.00 $35.00
Pack Size： 5g
Purity： 95%
in stock
$122.00 $85.00
Pack Size： 25g
Purity： 95%
in stock
$436.00 $305.00
Pack Size： 100g
Purity： 95%
in stock
$1,579.00 $1,105.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00FBBO
Chemical Name: tert-Butyl 1-methyl-4-nitro-1H-pyrrole-2-carboxylate
CAS Number: 67974-08-7
Molecular Formula: C10H14N2O4
Molecular Weight: 226.2292
MDL Number: MFCD00631285
SMILES: O=C(c1cc(cn1C)[N+](=O)[O-])OC(C)(C)C
Properties
Complexity: 292  
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: 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: 1.7  
Downstream Synthesis Route
120122-47-6    865-48-5    67974-08-7 

[1]Wurtz,NicholasR.;Turner,JamesM.;Baird,EldonE.;Dervan,PeterB.[OrganicLetters,2001,vol.3,#8,p.1201-1203]

[2]CurrentPatentAssignee:SHANGHAIMUSEHEALTHTECH-CN109970617,2019,ALocationinpatent:Paragraph0072;0109-0113

21898-65-7    67974-08-7 

[1]Wurtz,NicholasR.;Turner,JamesM.;Baird,EldonE.;Dervan,PeterB.[OrganicLetters,2001,vol.3,#8,p.1201-1203]

[2]CurrentPatentAssignee:SHANGHAIMUSEHEALTHTECH-CN109970617,2019,A

67974-08-7    1309686-53-0 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2011/130398,2011,A1Locationinpatent:Page/Pagecolumn82

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