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460750-27-0,MFCD11045613
Catalog No.:AA00DTWZ

460750-27-0 | ETHYL-2-AMINO-4,5-DIETHOXYBENZOATE

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  • Technical Information
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DTWZ
Chemical Name:
ETHYL-2-AMINO-4,5-DIETHOXYBENZOATE
CAS Number:
460750-27-0
Molecular Formula:
C13H19NO4
Molecular Weight:
253.2943
MDL Number:
MFCD11045613
SMILES:
CCOC1=C(C=C(C(=C1)C(=O)OCC)N)OCC
Properties
Computed Properties
 
Complexity:
259  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
7  
XLogP3:
2.7  

Downstream Synthesis Route

[1]Wright,StephenW.;Carlo,AnthonyA.;Carty,MaynardD.;Danley,DennisE.;Hageman,DavidL.;Karam,GeorgeA.;Levy,CarolynB.;Mansour,MahmoudN.;Mathiowetz,AlanM.;McClure,LesterD.;Nestor,NestorB.;McPherson,R.Kirk;Pandit,Jayvardhan;Pustilnik,LeslieR.;Schulte,GayleK.;Soeller,WalterC.;Treadway,JudithL.;Wan,Ing-Kae;Bauer,PaulH.[JournalofMedicinalChemistry,2002,vol.45,#18,p.3865-3877]

[1]Wright,StephenW.;Carlo,AnthonyA.;Carty,MaynardD.;Danley,DennisE.;Hageman,DavidL.;Karam,GeorgeA.;Levy,CarolynB.;Mansour,MahmoudN.;Mathiowetz,AlanM.;McClure,LesterD.;Nestor,NestorB.;McPherson,R.Kirk;Pandit,Jayvardhan;Pustilnik,LeslieR.;Schulte,GayleK.;Soeller,WalterC.;Treadway,JudithL.;Wan,Ing-Kae;Bauer,PaulH.[JournalofMedicinalChemistry,2002,vol.45,#18,p.3865-3877]

Literature
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SDS
Tags:460750-27-0 Molecular Formula|460750-27-0 MDL|460750-27-0 SMILES|460750-27-0 ETHYL-2-AMINO-4,5-DIETHOXYBENZOATE