5323-47-7,MFCD00454141
Catalog No.:AA00DIQL

5323-47-7 | N,N-Diethyl-4-nitrobenzamide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$91.00   $64.00
- +
5g
97%
in stock  
$250.00   $175.00
- +
10g
97%
in stock  
$408.00   $286.00
- +
25g
97%
in stock  
$583.00 $408.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DIQL
Chemical Name:
N,N-Diethyl-4-nitrobenzamide
CAS Number:
5323-47-7
Molecular Formula:
C11H14N2O3
Molecular Weight:
222.2405
MDL Number:
MFCD00454141
SMILES:
CCN(C(=O)c1ccc(cc1)[N+](=O)[O-])CC
NSC Number:
2768
Properties
Properties
 
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
250  
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:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.1  

Downstream Synthesis Route

[1]Gholinejad,Mohammad;Oftadeh,Erfan;Shojafar,Mohammad;Sansano,JoséM.;Lipshutz,BruceH.[ChemSusChem,2019,vol.12,#18,p.4240-4248]

[2]Gholinejad,Mohammad;Dasvarz,Neda;Shojafar,Mohammad;Sansano,JoséM.[InorganicaChimicaActa,2019,vol.495]

[3]Chiba,Mayumi;Ichikawa,Yuki;Kamiya,Mako;Komatsu,Toru;Ueno,Tasuku;Hanaoka,Kenjiro;Nagano,Tetsuo;Lange,Norbert;Urano,Yasuteru[AngewandteChemie-InternationalEdition,2017,vol.56,#35,p.10418-10422][Angew.Chem.,2017,vol.129,#35,p.10554-10558]

[4]CurrentPatentAssignee:PROLYNX-WO2015/51307,2015,A1Locationinpatent:Paragraph0059

[5]Srivastava,Neera;Gupta,AnuragAteet;Gupta,AnilK.Sen[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1982,vol.21,p.787-789]

[6]Li,Xinyu;Shi,Binyu;Teng,Yu;Cheng,Yu;Yang,Huizhu;Li,Jiurong;Wang,Lianjian;He,Siying;You,Qidong;Xiang,Hua[MedChemComm,2019,vol.10,#2,p.294-299]

[7]Chugh,Vishal;Chatterjee,Basujit;Chang,Wei-Chieh;Cramer,HannaH.;Hindemith,Carsten;Randel,Helena;Weyhermüller,Thomas;Farès,Christophe;Werlé,Christophe[AngewandteChemie-InternationalEdition,2022,vol.61,#36][Angew.Chem.,2022,vol.134,#36]

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

[9]CurrentPatentAssignee:PROLYNX-WO2011/140393,2011,A1Locationinpatent:Page/Pagecolumn44

[10]CurrentPatentAssignee:PROLYNX-WO2013/36857,2013,A1Locationinpatent:Paragraph0085

[11]CurrentPatentAssignee:PROLYNX-WO2013/36847,2013,A1Locationinpatent:Paragraph0114

[12]Piao,Wen;Hanaoka,Kenjiro;Fujisawa,Tomotsumi;Takeuchi,Satoshi;Komatsu,Toru;Ueno,Tasuku;Terai,Takuya;Tahara,Tahei;Nagano,Tetsuo;Urano,Yasuteru[JournaloftheAmericanChemicalSociety,2017,vol.139,#39,p.13713-13719]

[13]CurrentPatentAssignee:PROLYNX-US2017/312368,2017,A1Locationinpatent:Paragraph01

[14]Khosravi,Faezeh;Gholinejad,Mohammad;Sansano,JoséM.;Luque,Rafael[AppliedOrganometallicChemistry,2022,vol.36,#7]

[1]Movassagh;Lakouraj;Ghodrati[SyntheticCommunications,2000,vol.30,#13,p.2353-2358]

[2]Movassagh;Lakouraj;Gholami[Phosphorus,SulfurandSiliconandtheRelatedElements,2003,vol.178,#7,p.1507-1511]Movassagh;Lakouraj;Gholami[Phosphorus,SulfurandSiliconandtheRelatedElements,2003,vol.178,#9,p.1943-1947]

[3]Baganz;Kessler[ChemischeBerichte,1955,vol.88,p.1995]

[1]Chiba,Mayumi;Ichikawa,Yuki;Kamiya,Mako;Komatsu,Toru;Ueno,Tasuku;Hanaoka,Kenjiro;Nagano,Tetsuo;Lange,Norbert;Urano,Yasuteru[AngewandteChemie-InternationalEdition,2017,vol.56,#35,p.10418-10422][Angew.Chem.,2017,vol.129,#35,p.10554-10558]

[2]CurrentPatentAssignee:PROLYNX-WO2015/51307,2015,A1Locationinpatent:Paragraph0058

[3]Piao,Wen;Hanaoka,Kenjiro;Fujisawa,Tomotsumi;Takeuchi,Satoshi;Komatsu,Toru;Ueno,Tasuku;Terai,Takuya;Tahara,Tahei;Nagano,Tetsuo;Urano,Yasuteru[JournaloftheAmericanChemicalSociety,2017,vol.139,#39,p.13713-13719]

[4]Cerny,MatthewA.;Hanzlik,RobertP.[JournaloftheAmericanChemicalSociety,2006,vol.128,#10,p.3346-3354]

[5]Erlenmeyer;Jung;Sorkin[HelveticaChimicaActa,1946,vol.29,p.1960,1961]

[6]Martani,A.etal.[BollettinoChimicoFarmaceutico,1962,vol.101,p.829-840]Gryf-Keller,Adam;Terpinski,Jacek;Zajaczkowska-Terpinska,Ewa[PolishJournalofChemistry,1980,vol.54,#7/8,p.1465-1471]

[7]CurrentPatentAssignee:PROLYNX-WO2011/140393,2011,A1Locationinpatent:Page/Pagecolumn44

[8]CurrentPatentAssignee:PROLYNX-WO2013/36857,2013,A1Locationinpatent:Paragraph0084

[9]CurrentPatentAssignee:PROLYNX-WO2013/36847,2013,A1Locationinpatent:Paragraph0113

[10]CurrentPatentAssignee:PROLYNX-US2017/312368,2017,A1Locationinpatent:Paragraph0214-0215

[1]Bumagin,N.A.;Gulevich,Yu.N.;Beletskaya,I.P.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1984,vol.33,p.879][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1984,#4,p.953]

[2]Bumagin,N.A.;Gulevich,Yu.V.;Beletskaya,I.P.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1986,vol.35,p.1498-1504][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1986,#7,p.1649-1656]

[3]Bumagin,N.A.;Gulevich,Yu.V.;Beletskaya,I.P.[JournalofOrganometallicChemistry,1985,vol.285,p.415-418]

[1]Idoux,JohnP.;Madenwald,MarkL.;Garcia,BrentS.;Chu,Der-Lun;Gupton,JohnT.[JournalofOrganicChemistry,1985,vol.50,#11,p.1876-1878]

Literature
Quotation Request
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Additional Info:
SDS
Tags:5323-47-7 Molecular Formula|5323-47-7 MDL|5323-47-7 SMILES|5323-47-7 N,N-Diethyl-4-nitrobenzamide
Catalog No.: AA00DIQL
5323-47-7,MFCD00454141
5323-47-7 | N,N-Diethyl-4-nitrobenzamide
Pack Size: 1g
Purity: 97%
in stock
$91.00 $64.00
Pack Size: 5g
Purity: 97%
in stock
$250.00 $175.00
Pack Size: 10g
Purity: 97%
in stock
$408.00 $286.00
Pack Size: 25g
Purity: 97%
in stock
$583.00 $408.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00DIQL
Chemical Name: N,N-Diethyl-4-nitrobenzamide
CAS Number: 5323-47-7
Molecular Formula: C11H14N2O3
Molecular Weight: 222.2405
MDL Number: MFCD00454141
SMILES: CCN(C(=O)c1ccc(cc1)[N+](=O)[O-])CC
NSC Number: 2768
Properties
Storage: Room Temperature;  
Complexity: 250  
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: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.1  
Downstream Synthesis Route
5323-47-7    51207-85-3 

[1]Gholinejad,Mohammad;Oftadeh,Erfan;Shojafar,Mohammad;Sansano,JoséM.;Lipshutz,BruceH.[ChemSusChem,2019,vol.12,#18,p.4240-4248]

[2]Gholinejad,Mohammad;Dasvarz,Neda;Shojafar,Mohammad;Sansano,JoséM.[InorganicaChimicaActa,2019,vol.495]

[3]Chiba,Mayumi;Ichikawa,Yuki;Kamiya,Mako;Komatsu,Toru;Ueno,Tasuku;Hanaoka,Kenjiro;Nagano,Tetsuo;Lange,Norbert;Urano,Yasuteru[AngewandteChemie-InternationalEdition,2017,vol.56,#35,p.10418-10422][Angew.Chem.,2017,vol.129,#35,p.10554-10558]

[4]CurrentPatentAssignee:PROLYNX-WO2015/51307,2015,A1Locationinpatent:Paragraph0059

[5]Srivastava,Neera;Gupta,AnuragAteet;Gupta,AnilK.Sen[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1982,vol.21,p.787-789]

[6]Li,Xinyu;Shi,Binyu;Teng,Yu;Cheng,Yu;Yang,Huizhu;Li,Jiurong;Wang,Lianjian;He,Siying;You,Qidong;Xiang,Hua[MedChemComm,2019,vol.10,#2,p.294-299]

[7]Chugh,Vishal;Chatterjee,Basujit;Chang,Wei-Chieh;Cramer,HannaH.;Hindemith,Carsten;Randel,Helena;Weyhermüller,Thomas;Farès,Christophe;Werlé,Christophe[AngewandteChemie-InternationalEdition,2022,vol.61,#36][Angew.Chem.,2022,vol.134,#36]

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

[9]CurrentPatentAssignee:PROLYNX-WO2011/140393,2011,A1Locationinpatent:Page/Pagecolumn44

[10]CurrentPatentAssignee:PROLYNX-WO2013/36857,2013,A1Locationinpatent:Paragraph0085

[11]CurrentPatentAssignee:PROLYNX-WO2013/36847,2013,A1Locationinpatent:Paragraph0114

[12]Piao,Wen;Hanaoka,Kenjiro;Fujisawa,Tomotsumi;Takeuchi,Satoshi;Komatsu,Toru;Ueno,Tasuku;Terai,Takuya;Tahara,Tahei;Nagano,Tetsuo;Urano,Yasuteru[JournaloftheAmericanChemicalSociety,2017,vol.139,#39,p.13713-13719]

[13]CurrentPatentAssignee:PROLYNX-US2017/312368,2017,A1Locationinpatent:Paragraph01

[14]Khosravi,Faezeh;Gholinejad,Mohammad;Sansano,JoséM.;Luque,Rafael[AppliedOrganometallicChemistry,2022,vol.36,#7]

17376-44-2    5323-47-7 

[1]Movassagh;Lakouraj;Ghodrati[SyntheticCommunications,2000,vol.30,#13,p.2353-2358]

[2]Movassagh;Lakouraj;Gholami[Phosphorus,SulfurandSiliconandtheRelatedElements,2003,vol.178,#7,p.1507-1511]Movassagh;Lakouraj;Gholami[Phosphorus,SulfurandSiliconandtheRelatedElements,2003,vol.178,#9,p.1943-1947]

[3]Baganz;Kessler[ChemischeBerichte,1955,vol.88,p.1995]

122-04-3    109-89-7    5323-47-7 

[1]Chiba,Mayumi;Ichikawa,Yuki;Kamiya,Mako;Komatsu,Toru;Ueno,Tasuku;Hanaoka,Kenjiro;Nagano,Tetsuo;Lange,Norbert;Urano,Yasuteru[AngewandteChemie-InternationalEdition,2017,vol.56,#35,p.10418-10422][Angew.Chem.,2017,vol.129,#35,p.10554-10558]

[2]CurrentPatentAssignee:PROLYNX-WO2015/51307,2015,A1Locationinpatent:Paragraph0058

[3]Piao,Wen;Hanaoka,Kenjiro;Fujisawa,Tomotsumi;Takeuchi,Satoshi;Komatsu,Toru;Ueno,Tasuku;Terai,Takuya;Tahara,Tahei;Nagano,Tetsuo;Urano,Yasuteru[JournaloftheAmericanChemicalSociety,2017,vol.139,#39,p.13713-13719]

[4]Cerny,MatthewA.;Hanzlik,RobertP.[JournaloftheAmericanChemicalSociety,2006,vol.128,#10,p.3346-3354]

[5]Erlenmeyer;Jung;Sorkin[HelveticaChimicaActa,1946,vol.29,p.1960,1961]

[6]Martani,A.etal.[BollettinoChimicoFarmaceutico,1962,vol.101,p.829-840]Gryf-Keller,Adam;Terpinski,Jacek;Zajaczkowska-Terpinska,Ewa[PolishJournalofChemistry,1980,vol.54,#7/8,p.1465-1471]

[7]CurrentPatentAssignee:PROLYNX-WO2011/140393,2011,A1Locationinpatent:Page/Pagecolumn44

[8]CurrentPatentAssignee:PROLYNX-WO2013/36857,2013,A1Locationinpatent:Paragraph0084

[9]CurrentPatentAssignee:PROLYNX-WO2013/36847,2013,A1Locationinpatent:Paragraph0113

[10]CurrentPatentAssignee:PROLYNX-US2017/312368,2017,A1Locationinpatent:Paragraph0214-0215

636-98-6    201230-82-2    1068-74-2    5323-47-7 

[1]Bumagin,N.A.;Gulevich,Yu.N.;Beletskaya,I.P.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1984,vol.33,p.879][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1984,#4,p.953]

[2]Bumagin,N.A.;Gulevich,Yu.V.;Beletskaya,I.P.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1986,vol.35,p.1498-1504][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1986,#7,p.1649-1656]

[3]Bumagin,N.A.;Gulevich,Yu.V.;Beletskaya,I.P.[JournalofOrganometallicChemistry,1985,vol.285,p.415-418]

5323-47-7    420-87-1    96326-11-3 

[1]Idoux,JohnP.;Madenwald,MarkL.;Garcia,BrentS.;Chu,Der-Lun;Gupton,JohnT.[JournalofOrganicChemistry,1985,vol.50,#11,p.1876-1878]

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