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888325-29-9,MFCD18157601
Catalog No.:AA00H2O3

888325-29-9 | 4-Hydroxy-3,3-dimethylcyclohexanone

Pack Size
Purity
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Price(USD)
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25mg
95+%
1 week  
$183.00   $128.00
- +
50mg
95+%
1 week  
$310.00   $217.00
- +
100mg
95+%
1 week  
$525.00   $368.00
- +
250mg
95+%
1 week  
$893.00   $625.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00H2O3
Chemical Name:
4-Hydroxy-3,3-dimethylcyclohexanone
CAS Number:
888325-29-9
Molecular Formula:
C8H14O2
Molecular Weight:
142.1956
MDL Number:
MFCD18157601
SMILES:
O=C1CCC(C(C1)(C)C)O
Properties
Computed Properties
 
Complexity:
149  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Undefined Atom Stereocenter Count:
1  
XLogP3:
0.6  

Downstream Synthesis Route

[1]CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-US2015/175557,2015,A1Locationinpatent:Paragraph0170

[2]Gemma,Sandra;Gabellieri,Emanuele;Huleatt,Paul;Fattorusso,Caterina;Borriello,Marianna;Catalanotti,Bruno;Butini,Stefania;DeAngelis,Meri;Novellino,Ettore;Nacci,Vito;Belinskaya,Tatyana;Saxena,Ashima;Campiani,Giuseppe[JournalofMedicinalChemistry,2006,vol.49,#11,p.3421-3425]

[3]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2018/158212,2018,A1Locationinpatent:Page/Pagecolumn76

[1]Gemma,Sandra;Gabellieri,Emanuele;Huleatt,Paul;Fattorusso,Caterina;Borriello,Marianna;Catalanotti,Bruno;Butini,Stefania;DeAngelis,Meri;Novellino,Ettore;Nacci,Vito;Belinskaya,Tatyana;Saxena,Ashima;Campiani,Giuseppe[JournalofMedicinalChemistry,2006,vol.49,#11,p.3421-3425]

[1]Gemma,Sandra;Gabellieri,Emanuele;Huleatt,Paul;Fattorusso,Caterina;Borriello,Marianna;Catalanotti,Bruno;Butini,Stefania;DeAngelis,Meri;Novellino,Ettore;Nacci,Vito;Belinskaya,Tatyana;Saxena,Ashima;Campiani,Giuseppe[JournalofMedicinalChemistry,2006,vol.49,#11,p.3421-3425]

888325-29-9   
(+/-)-7-(2-methoxyethoxy)methoxy-3,6,6-trimethyl-9-oxobicyclo3.3.1non-3-ene-1-carboxylicacidmethylester 

[1]Gemma,Sandra;Gabellieri,Emanuele;Huleatt,Paul;Fattorusso,Caterina;Borriello,Marianna;Catalanotti,Bruno;Butini,Stefania;DeAngelis,Meri;Novellino,Ettore;Nacci,Vito;Belinskaya,Tatyana;Saxena,Ashima;Campiani,Giuseppe[JournalofMedicinalChemistry,2006,vol.49,#11,p.3421-3425]

888325-29-9   
(+/-)-(9Z)-7-((2-methoxyethoxy)methoxy)-9-ethylidene-3,6,6-trimethylbicyclo3.3.1non-3-ene-1-carboxylicacidmethylester 

[1]Gemma,Sandra;Gabellieri,Emanuele;Huleatt,Paul;Fattorusso,Caterina;Borriello,Marianna;Catalanotti,Bruno;Butini,Stefania;DeAngelis,Meri;Novellino,Ettore;Nacci,Vito;Belinskaya,Tatyana;Saxena,Ashima;Campiani,Giuseppe[JournalofMedicinalChemistry,2006,vol.49,#11,p.3421-3425]

Literature

Title: Sandra Gemma , et al. Discovery of Huperzine A-tacrine Hybrids as Potent Inhibitors of Human Cholinesterases Targeting Their Midgorge Recognition Sites. J Med Chem. 2006 Jun 1;49(11):3421-5.

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SDS
Tags:888325-29-9 Molecular Formula|888325-29-9 MDL|888325-29-9 SMILES|888325-29-9 4-Hydroxy-3,3-dimethylcyclohexanone