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136470-78-5,MFCD00903850
Catalog No.:AA0011TK

136470-78-5 | Abacavir

Pack Size
Purity
Availability
Price(USD)
Quantity
  
10mg
98%
in stock  
$6.00   $4.00
- +
50mg
98%
in stock  
$8.00   $6.00
- +
1g
98%(HPLC)
in stock  
$24.00   $17.00
- +
5g
98%(HPLC)
in stock  
$70.00   $49.00
- +
25g
98%
in stock  
$155.00   $109.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0011TK
Chemical Name:
Abacavir
CAS Number:
136470-78-5
Molecular Formula:
C14H18N6O
Molecular Weight:
286.3323
MDL Number:
MFCD00903850
SMILES:
OC[C@@H]1C=C[C@@H](C1)n1cnc2c1nc(N)nc2NC1CC1
Properties
Computed Properties
 
Complexity:
414  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.9  

Downstream Synthesis Route

[1]Crimmins,MichaelT.;King,BryanW.[JournalofOrganicChemistry,1996,vol.61,#13,p.4192-4193]

[2]Crimmins;King;Zuercher;Choy[JournalofOrganicChemistry,2000,vol.65,#25,p.8499-8509]

[3]Crimmins;King;Zuercher;Choy[JournalofOrganicChemistry,2000,vol.65,#25,p.8499-8509]

[1]Weising,Simon;Sterrenberg,Vincente;Schols,Dominique;Meier,Chris[ChemMedChem,2018,vol.13,#17,p.1771-1778]

[2]Olivo,HoracioF.;Yu,Jiaxin[JournaloftheChemicalSociety.PerkintransactionsI,1998,#3,p.391-392]

[3]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2005/23811,2005,A1Locationinpatent:Page/Pagecolumn7-8

[4]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2005/23811,2005,A1Locationinpatent:Page/Pagecolumn8

[5]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US5034394,1991,A

[1]Nucleosides,nucleotidesandnucleicacids,2000,vol.19,p.297-327

[2]Patent:US2017/233329,2017,A1.Locationinpatent:Paragraph0056;0057;0058;0059;0060

[3]Patent:EP1857458,2007,A1.Locationinpatent:Page/Pagecolumn5

[4]Patent:EP2305680,2011,A2.Locationinpatent:Page/Pagecolumn9

[5]Patent:CN107641122,2018,A.Locationinpatent:Paragraph0079-0080

136470-78-5   
(1R,cis)-3-2-amino-6-(cyclopropylamino)-9H-purin-9-yl-1-cyclopentane-1-methanol 

[1]Daluge,SusanM.;Martin,MichaelT.;Sickles,BarryR.;Livingston,DouglasA.[Nucleosides,nucleotidesandnucleicacids,2000,vol.19,#1-2,p.297-327]

[1]Crimmins;Zuercher[Organicletters,2000,vol.2,#8,p.1065-1067]

Literature
Quotation Request
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SDS
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Tags:136470-78-5 Molecular Formula|136470-78-5 MDL|136470-78-5 SMILES|136470-78-5 Abacavir
Catalog No.: AA0011TK
136470-78-5,MFCD00903850
136470-78-5 | Abacavir
Pack Size： 10mg
Purity： 98%
in stock
$6.00 $4.00
Pack Size： 50mg
Purity： 98%
in stock
$8.00 $6.00
Pack Size： 1g
Purity： 98%(HPLC)
in stock
$24.00 $17.00
Pack Size： 5g
Purity： 98%(HPLC)
in stock
$70.00 $49.00
Pack Size： 25g
Purity： 98%
in stock
$155.00 $109.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0011TK
Chemical Name: Abacavir
CAS Number: 136470-78-5
Molecular Formula: C14H18N6O
Molecular Weight: 286.3323
MDL Number: MFCD00903850
SMILES: OC[C@@H]1C=C[C@@H](C1)n1cnc2c1nc(N)nc2NC1CC1
Properties
Complexity: 414  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 2  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 21  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 3  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.9  
Downstream Synthesis Route
178456-36-5    136470-78-5 

[1]Crimmins,MichaelT.;King,BryanW.[JournalofOrganicChemistry,1996,vol.61,#13,p.4192-4193]

[2]Crimmins;King;Zuercher;Choy[JournalofOrganicChemistry,2000,vol.65,#25,p.8499-8509]

[3]Crimmins;King;Zuercher;Choy[JournalofOrganicChemistry,2000,vol.65,#25,p.8499-8509]

136522-33-3    765-30-0    136470-78-5 

[1]Weising,Simon;Sterrenberg,Vincente;Schols,Dominique;Meier,Chris[ChemMedChem,2018,vol.13,#17,p.1771-1778]

[2]Olivo,HoracioF.;Yu,Jiaxin[JournaloftheChemicalSociety.PerkintransactionsI,1998,#3,p.391-392]

[3]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2005/23811,2005,A1Locationinpatent:Page/Pagecolumn7-8

[4]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2005/23811,2005,A1Locationinpatent:Page/Pagecolumn8

[5]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US5034394,1991,A

765-30-0    172015-79-1    136470-78-5 

[1]Nucleosides,nucleotidesandnucleicacids,2000,vol.19,p.297-327

[2]Patent:US2017/233329,2017,A1.Locationinpatent:Paragraph0056;0057;0058;0059;0060

[3]Patent:EP1857458,2007,A1.Locationinpatent:Page/Pagecolumn5

[4]Patent:EP2305680,2011,A2.Locationinpatent:Page/Pagecolumn9

[5]Patent:CN107641122,2018,A.Locationinpatent:Paragraph0079-0080

136470-78-5   
(1R,cis)-3-2-amino-6-(cyclopropylamino)-9H-purin-9-yl-1-cyclopentane-1-methanol 

[1]Daluge,SusanM.;Martin,MichaelT.;Sickles,BarryR.;Livingston,DouglasA.[Nucleosides,nucleotidesandnucleicacids,2000,vol.19,#1-2,p.297-327]

10310-21-1    765-30-0    268737-86-6    136470-78-5 

[1]Crimmins;Zuercher[Organicletters,2000,vol.2,#8,p.1065-1067]

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