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Home Amines 764659-72-5
764659-72-5,MFCD09753268
Catalog No.:AA0039TW

764659-72-5 | (2R,5S)-(1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl 5-(4-amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolane-2-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$29.00   $20.00
- +
5g
98%
in stock  
$37.00   $26.00
- +
25g
98%
in stock  
$79.00   $55.00
- +
100g
98%
in stock  
$211.00   $148.00
- +
500g
98%
in stock  
$909.00   $637.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0039TW
Chemical Name:
(2R,5S)-(1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl 5-(4-amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolane-2-carboxylate
CAS Number:
764659-72-5
Molecular Formula:
C18H26FN3O4S
Molecular Weight:
399.4801
MDL Number:
MFCD09753268
SMILES:
C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[C@H]1SC[C@H](O1)n1cc(F)c(nc1=O)N)C(C)C
Properties
Computed Properties
 
Complexity:
669  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
3.2  

Upstream Synthesis Route

[1]Patent:CN104487437,2017,B,.Locationinpatent:Paragraph0155-00157

[2]Patent:WO2011/120927,2011,A1,.Locationinpatent:Page/Pagecolumn12-13

[3]Patent:EP2377862,2011,A1,.Locationinpatent:Page/Pagecolumn7

[4]Patent:WO2012/131541,2012,A1,.Locationinpatent:Page/Pagecolumn25-26

[5]Patent:WO2007/77505,2007,A2,.Locationinpatent:Page/Pagecolumn9

[6]Patent:WO2004/85432,2004,A1,.Locationinpatent:Page14

[7]Patent:WO2013/21290,2013,A1,.Locationinpatent:Page/Pagecolumn27;28

[8]Patent:WO2014/174532,2014,A2,.Locationinpatent:Page/Pagecolumn9;15;16

[9]Patent:CN106478618,2017,A,.Locationinpatent:Paragraph0051;0053

[1]OrganicLetters,2015,vol.17,#11,p.2626-2629

[2]Patent:WO2013/21290,2013,A1,.Locationinpatent:Page/Pagecolumn24;25

[1]Patent:WO2007/77505,2007,A2,.Locationinpatent:Page/Pagecolumn8

[1]Patent:CN106496208,2017,A,.Locationinpatent:Paragraph0047;0048;0049

[2]Patent:CN106478618,2017,A,.Locationinpatent:Paragraph0048;0049;0050

[1]Patent:WO2009/84033,2009,A2,.Locationinpatent:Page/Pagecolumn8-9

Downstream Synthesis Route

[1]Patent:CN104487437,2017,B.Locationinpatent:Paragraph0155-00157

[2]Patent:WO2011/120927,2011,A1.Locationinpatent:Page/Pagecolumn12-13

[3]Patent:EP2377862,2011,A1.Locationinpatent:Page/Pagecolumn7

[4]Patent:WO2012/131541,2012,A1.Locationinpatent:Page/Pagecolumn25-26

[5]Patent:WO2007/77505,2007,A2.Locationinpatent:Page/Pagecolumn9

[6]Patent:WO2004/85432,2004,A1.Locationinpatent:Page14

[7]Patent:WO2013/21290,2013,A1.Locationinpatent:Page/Pagecolumn27;28

[8]Patent:WO2014/174532,2014,A2.Locationinpatent:Page/Pagecolumn9;15;16

[9]Patent:CN106478618,2017,A.Locationinpatent:Paragraph0051;0053

[10]Patent:CN110467608,2019,A.Locationinpatent:Paragraph0028;0035;0036;0038

5-chloro-1,3oxathiolane-2-carboxylicacid2-isopropyl-5-methyl-cyclohexylester 
  764659-72-5 

[1]Patent:WO2004/85432,2004,A1.Locationinpatent:Page12-13

[2]Patent:WO2011/95987,2011,A1

[1]Patent:WO2004/85432,2004,A1.Locationinpatent:Page14

[1]Patent:WO2007/77505,2007,A2.Locationinpatent:Page/Pagecolumn8

[1]Patent:WO2009/84033,2009,A2.Locationinpatent:Page/Pagecolumn9-10

Literature
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SDS
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Tags:764659-72-5 Molecular Formula|764659-72-5 MDL|764659-72-5 SMILES|764659-72-5 (2R,5S)-(1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl 5-(4-amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolane-2-carboxylate