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Home Nitro Compounds 17547-09-0
17547-09-0,MFCD00057613
Catalog No.:AA0077EN

17547-09-0 | Boc-beta-alanine 4-nitrophenyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$79.00   $55.00
- +
5g
98%
in stock  
$261.00   $183.00
- +
25g
98%
in stock  
$793.00   $555.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0077EN
Chemical Name:
Boc-beta-alanine 4-nitrophenyl ester
CAS Number:
17547-09-0
Molecular Formula:
C14H18N2O6
Molecular Weight:
310.3025
MDL Number:
MFCD00057613
SMILES:
O=C(Oc1ccc(cc1)[N+](=O)[O-])CCNC(=O)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
405  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
7  
XLogP3:
2.1  

Downstream Synthesis Route
17547-09-0   
β-alanine4-nitrophenylesterperchlorate 

[1]Cram,DonaldJ.;Katz,HowardEdan;Dicker,IraB.[JournaloftheAmericanChemicalSociety,1984,vol.106,#17,p.4987-5000]

[1]Sekizaki,Haruo;Itoh,Kunihiko;Toyota,Eiko;Tanizawa,Kazutaka[ChemicalandPharmaceuticalBulletin,1998,vol.46,#5,p.846-849]

17547-09-0   
3-tert-Butoxycarbonylamino-propionicacid4-amino-phenylester 

[1]Sekizaki,Haruo;Itoh,Kunihiko;Toyota,Eiko;Tanizawa,Kazutaka[ChemicalandPharmaceuticalBulletin,1998,vol.46,#5,p.846-849]

[1]Benoist,E.;Fourteau,L.;Coulais,Y.;Dartiguenave,M.[Journaloflabelledcompoundsandradiopharmaceuticals,2001,vol.44,p.S521-S523]

2987-53-3    17547-09-0   
2-(2-methylsulfanyl-phenylcarbamoyl)-ethyl-carbamicacid<i>tert</i>-butylester 

[1]Benoist,E.;Fourteau,L.;Coulais,Y.;Dartiguenave,M.[Journaloflabelledcompoundsandradiopharmaceuticals,2001,vol.44,p.S521-S523]

Literature
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