Home Fluorides 1254104-06-7
1254104-06-7,MFCD19443907
Catalog No.:AA000NKU

1254104-06-7 | 3,3-Difluoro-8-azabicyclo[3.2.1]octane hydrochloride

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$255.00   $179.00
- +
250mg
95%
in stock  
$408.00   $286.00
- +
500mg
95%
in stock  
$679.00   $476.00
- +
1g
95
in stock  
$943.00   $660.00
- +
5g
95%
in stock  
$3,054.00   $2,138.00
- +
25g
95
in stock  
$13,586.00   $9,510.00
- +
100g
95
in stock  
$40,729.00   $28,510.00
- +
  • Technical Information
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000NKU
Chemical Name:
3,3-Difluoro-8-azabicyclo[3.2.1]octane hydrochloride
CAS Number:
1254104-06-7
Molecular Formula:
C7H12ClF2N
Molecular Weight:
183.6267
MDL Number:
MFCD19443907
SMILES:
FC1(F)CC2CCC(C1)N2.Cl
Properties
Computed Properties
 
Complexity:
133  
Covalently-Bonded Unit Count:
2  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Undefined Atom Stereocenter Count:
2  

Downstream Synthesis Route

[1]CurrentPatentAssignee:MERCK&COINC-WO2010/126163,2010,A1Locationinpatent:Page/Pagecolumn39

1254104-06-7   
5-((2,5-dichloropyrimidin-4-yl)amino)-3-(3-hydroxy-3-methylbutyl)-1-methyl-1,3-dihydro-2H-benzodimidazol-2-one 
 
5-((5-chloro-2-(3,3-difluoro-8-azabicyclo3.2.1octan-8-yl)-pyrimidin-4-yl)amino)-3-(3-hydroxy-3-methylbutyl)-1-methyl-1,3-dihydro-2H-benzodimidazol-2-one 

[1]Bellenie,BenjaminR.;Cheung,Kwai-MingJ.;Varela,Ana;Pierrat,OlivierA.;Collie,GavinW.;Box,GaryM.;Bright,MichaelD.;Gowan,Sharon;Hayes,Angela;Rodrigues,MatthewJ.;Shetty,KartikaN.;Carter,Michael;Davis,OwenA.;Henley,AlanT.;Innocenti,Paolo;Johnson,LouiseD.;Liu,Manjuan;DeKlerk,Selby;LeBihan,Yann-Vaï;Lloyd,MatthewG.;McAndrew,P.Craig;Shehu,Erald;Talbot,Rachel;Woodward,HannahL.;Burke,Rosemary;Kirkin,Vladimir;VanMontfort,RobL.M.;Raynaud,FlorenceI.;Rossanese,OliviaW.;Hoelder,Swen[JournalofMedicinalChemistry,2020,vol.63,#8,p.4047-4068]

[2]CurrentPatentAssignee:UNIVERSITYOFLONDON;CANCERRESEARCHUK-WO2018/215801,2018,A1Locationinpatent:Paragraph00298;00299

Literature
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SDS
Tags:1254104-06-7 Molecular Formula|1254104-06-7 MDL|1254104-06-7 SMILES|1254104-06-7 3,3-Difluoro-8-azabicyclo[3.2.1]octane hydrochloride