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50445-50-6,MFCD01211872
Catalog No.:AA00I8ZJ

50445-50-6 | N-Ethyl-4-nitrobenzamide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$147.00   $103.00
- +
5g
98%
in stock  
$464.00   $325.00
- +
10g
98%
in stock  
$734.00 $514.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00I8ZJ
Chemical Name:
N-Ethyl-4-nitrobenzamide
CAS Number:
50445-50-6
Molecular Formula:
C9H10N2O3
Molecular Weight:
194.1873
MDL Number:
MFCD01211872
SMILES:
CCNC(=O)c1ccc(cc1)[N+](=O)[O-]
NSC Number:
406844
Properties
Computed Properties
 
Complexity:
217  
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:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.3  

Downstream Synthesis Route

[1]Clark;Wells;Sansom;etal.[JournalofMedicinalChemistry,1984,vol.27,#6,p.779-782]

[2]Ryabchuk,Pavel;Junge,Kathrin;Beller,Matthias[Synthesis,2018,vol.50,#22,p.4369-4376]

[3]CurrentPatentAssignee:GUANGZHOUNUOCHENGJIANHUAPHARMACEUTICALTECH;GUANGZHOUINNOCAREPHARMATECH;GUANGZHOUINNOCAREPHARMATECHCOLTD-CN112142743,2020,ALocationinpatent:Paragraph0213-0216;0222-0226

[4]CurrentPatentAssignee:GUANGZHOUNUOCHENGJIANHUAPHARMACEUTICALTECH;GUANGZHOUINNOCAREPHARMATECH;GUANGZHOUINNOCAREPHARMATECHCOLTD-WO2020/259584,2020,A1Locationinpatent:Page/Pagecolumn44;45

[5]Wenker[JournaloftheAmericanChemicalSociety,1938,vol.60,p.1081]

[1]Hajipour;Ghasemi[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2001,vol.40,#6,p.504-507]

[2]CurrentPatentAssignee:GUANGZHOUINNOCAREPHARMATECH;GUANGZHOUINNOCAREPHARMATECHCOLTD;GUANGZHOUNUOCHENGJIANHUAPHARMACEUTICALTECH-CN112142743,2020,ALocationinpatent:Paragraph0213-0221

[3]CurrentPatentAssignee:GUANGZHOUINNOCAREPHARMATECH;GUANGZHOUINNOCAREPHARMATECHCOLTD;GUANGZHOUNUOCHENGJIANHUAPHARMACEUTICALTECH-WO2020/259584,2020,A1Locationinpatent:Page/Pagecolumn44;45

[1]Templ,Johanna;Gjata,Edma;Getzner,Filippa;Schnürch,Michael[OrganicLetters,2022,vol.24,#40,p.7315-7319]

Literature
Quotation Request
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SDS
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Tags:50445-50-6 Molecular Formula|50445-50-6 MDL|50445-50-6 SMILES|50445-50-6 N-Ethyl-4-nitrobenzamide
Catalog No.: AA00I8ZJ
50445-50-6,MFCD01211872
50445-50-6 | N-Ethyl-4-nitrobenzamide
Pack Size： 1g
Purity： 98%
in stock
$147.00 $103.00
Pack Size： 5g
Purity： 98%
in stock
$464.00 $325.00
Pack Size： 10g
Purity： 98%
in stock
$734.00 $514.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00I8ZJ
Chemical Name: N-Ethyl-4-nitrobenzamide
CAS Number: 50445-50-6
Molecular Formula: C9H10N2O3
Molecular Weight: 194.1873
MDL Number: MFCD01211872
SMILES: CCNC(=O)c1ccc(cc1)[N+](=O)[O-]
NSC Number: 406844
Properties
Complexity: 217  
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: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.3  
Downstream Synthesis Route
50445-50-6    89399-17-7 

[1]Clark;Wells;Sansom;etal.[JournalofMedicinalChemistry,1984,vol.27,#6,p.779-782]

[2]Ryabchuk,Pavel;Junge,Kathrin;Beller,Matthias[Synthesis,2018,vol.50,#22,p.4369-4376]

[3]CurrentPatentAssignee:GUANGZHOUNUOCHENGJIANHUAPHARMACEUTICALTECH;GUANGZHOUINNOCAREPHARMATECH;GUANGZHOUINNOCAREPHARMATECHCOLTD-CN112142743,2020,ALocationinpatent:Paragraph0213-0216;0222-0226

[4]CurrentPatentAssignee:GUANGZHOUNUOCHENGJIANHUAPHARMACEUTICALTECH;GUANGZHOUINNOCAREPHARMATECH;GUANGZHOUINNOCAREPHARMATECHCOLTD-WO2020/259584,2020,A1Locationinpatent:Page/Pagecolumn44;45

[5]Wenker[JournaloftheAmericanChemicalSociety,1938,vol.60,p.1081]

75-04-7    62-23-7    50445-50-6 

[1]Hajipour;Ghasemi[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2001,vol.40,#6,p.504-507]

[2]CurrentPatentAssignee:GUANGZHOUINNOCAREPHARMATECH;GUANGZHOUINNOCAREPHARMATECHCOLTD;GUANGZHOUNUOCHENGJIANHUAPHARMACEUTICALTECH-CN112142743,2020,ALocationinpatent:Paragraph0213-0221

[3]CurrentPatentAssignee:GUANGZHOUINNOCAREPHARMATECH;GUANGZHOUINNOCAREPHARMATECHCOLTD;GUANGZHOUNUOCHENGJIANHUAPHARMACEUTICALTECH-WO2020/259584,2020,A1Locationinpatent:Page/Pagecolumn44;45

1010-19-1    619-80-7    50445-50-6 

[1]Templ,Johanna;Gjata,Edma;Getzner,Filippa;Schnürch,Michael[OrganicLetters,2022,vol.24,#40,p.7315-7319]

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