Home Amines 209983-91-5
209983-91-5,MFCD01861208
Catalog No.:AA002KFL

209983-91-5 | (S)-3-Amino-1-benzyl-azepan-2-one

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Purity
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1g
98%
in stock  
$525.00   $368.00
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5g
98%
in stock  
$2,081.00   $1,457.00
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10g
98%
in stock  
$3,224.00   $2,257.00
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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:
AA002KFL
Chemical Name:
(S)-3-Amino-1-benzyl-azepan-2-one
CAS Number:
209983-91-5
Molecular Formula:
C13H18N2O
Molecular Weight:
218.2948
MDL Number:
MFCD01861208
SMILES:
O=C1[C@@H](N)CCCCN1Cc1ccccc1
Properties
Computed Properties
 
Complexity:
236  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.2  

Downstream Synthesis Route

[1]Kawabata,Takeo;Matsuda,Seiji;Kawakami,Shimpei;Monguchi,Daiki;Moriyama,Katsuhiko[JournaloftheAmericanChemicalSociety,2006,vol.128,#48,p.15394-15395]

[2]LeDiguarher,Thierry;Ortuno,Jean-Claude;Dorey,Gilbert;Shanks,David;Guilbaud,Nicolas;Pierre,Alain;Fauchere,Jean-Luc;Hickman,JohnA.;Tucker,GordonC.;Casara,PatrickJ.[BioorganicandMedicinalChemistry,2003,vol.11,#14,p.3193-3204]

Literature
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SDS
Tags:209983-91-5 Molecular Formula|209983-91-5 MDL|209983-91-5 SMILES|209983-91-5 (S)-3-Amino-1-benzyl-azepan-2-one