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Home Amines 157665-53-7
157665-53-7,MFCD08703399
Catalog No.:AA001PIU

157665-53-7 | Benzoic acid, 4-amino-3-fluoro-, 1,1-dimethylethyl ester

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Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$11.00   $8.00
- +
250mg
95%
in stock  
$18.00   $13.00
- +
1g
95%
in stock  
$62.00   $44.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001PIU
Chemical Name:
Benzoic acid, 4-amino-3-fluoro-, 1,1-dimethylethyl ester
CAS Number:
157665-53-7
Molecular Formula:
C11H14FNO2
Molecular Weight:
211.2328
MDL Number:
MFCD08703399
SMILES:
O=C(c1ccc(c(c1)F)N)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
237  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.3  

Downstream Synthesis Route

[1]Springer;Niculescu-Duvaz;Pedley[JournalofMedicinalChemistry,1994,vol.37,#15,p.2361-2370]

[1]Springer;Niculescu-Duvaz;Pedley[JournalofMedicinalChemistry,1994,vol.37,#15,p.2361-2370]

[2]CurrentPatentAssignee:BAYERAG-US2016/52884,2016,A1Locationinpatent:Paragraph0566;0661-0664

[1]Springer;Niculescu-Duvaz;Pedley[JournalofMedicinalChemistry,1994,vol.37,#15,p.2361-2370]

[1]Springer;Niculescu-Duvaz;Pedley[JournalofMedicinalChemistry,1994,vol.37,#15,p.2361-2370]

[1]Springer;Niculescu-Duvaz;Pedley[JournalofMedicinalChemistry,1994,vol.37,#15,p.2361-2370]

Literature
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SDS
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Tags:157665-53-7 Molecular Formula|157665-53-7 MDL|157665-53-7 SMILES|157665-53-7 Benzoic acid, 4-amino-3-fluoro-, 1,1-dimethylethyl ester