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Home Indole and Oxindoles 879687-90-8
879687-90-8,MFCD10758102
Catalog No.:AA00H2NT

879687-90-8 | 2-Benzylhexahydro-1H-isoindol-4(2H)-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$117.00   $82.00
- +
250mg
95%
in stock  
$178.00   $125.00
- +
500mg
95%
in stock  
$268.00   $188.00
- +
1g
95%
in stock  
$454.00   $318.00
- +
5g
95%
in stock  
$2,140.00   $1,498.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00H2NT
Chemical Name:
2-Benzylhexahydro-1H-isoindol-4(2H)-one
CAS Number:
879687-90-8
Molecular Formula:
C15H19NO
Molecular Weight:
229.3175
MDL Number:
MFCD10758102
SMILES:
O=C1CCCC2C1CN(C2)Cc1ccccc1
Properties
Computed Properties
 
Complexity:
283  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
2  
XLogP3:
2  

Downstream Synthesis Route
879687-90-8    16750-63-3   
(3ARS,4RS,7ASR)-2-benzyl-4-(2-methoxyphenyl)-4-perhydroisoindolol 

[1]Patent:US5624950,1997,A

879687-90-8    328-70-1   
(3ARS,4RS,7ASR)-2-benzyl-4-3,5-bis(trifluoromethyl)phenyl-4-perhydroisoindolol 

[1]Patent:US5624950,1997,A

930-68-7   
N-butoxymethyl-N-trimethylbenzylamine 
  879687-90-8 

[1]Patent:US5624950,1997,A

[1]Patent:WO2006/28961,2006,A2.Locationinpatent:Page/Pagecolumn72-73

[2]BioorganicandMedicinalChemistryLetters,2013,vol.23,p.6370-6376

[3]Patent:US2017/37050,2017,A1.Locationinpatent:Paragraph0168-0170

879687-90-8   
(rac)-cis-methyl4-hydroxy-4-(m-tolylethynyl)hexahydro-1H-isoindole-2(3H)-carboxylate 

[1]BioorganicandMedicinalChemistryLetters,2013,vol.23,p.6370-6376

Literature
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SDS
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