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177036-78-1,MFCD11865341
Catalog No.:AA002500

177036-78-1 | Methyl (2S)-2-hydroxy-3-methoxy-3,3-diphenylpropanoate

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002500
Chemical Name:
Methyl (2S)-2-hydroxy-3-methoxy-3,3-diphenylpropanoate
CAS Number:
177036-78-1
Molecular Formula:
C17H18O4
Molecular Weight:
286.3224
MDL Number:
MFCD11865341
SMILES:
COC([C@@H](C(=O)OC)O)(c1ccccc1)c1ccccc1
Properties
Properties
 
BP:
440.7±40.0°C at 760 mmHg  
Form:
Solid  
MP:
61-62℃  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
312  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
6  
XLogP3:
2.4  

Downstream Synthesis Route

[1]Patent:WO2013/57468,2013,A1.Locationinpatent:Page/Pagecolumn25

[2]JournalofMedicinalChemistry,1999,vol.42,p.3026-3032

[3]Patent:US6670367,2003,B1.Locationinpatent:Pagecolumn16

[1]Amberg,Willi;Hergenröder,Stefan;Hillen,Heinz;Jansen,Rolf;Kettschau,Georg;Kling,Andreas;Klinge,Dagmar;Raschack,Manfred;Riechers,Hartmut;Unger,Liliane[JournalofMedicinalChemistry,1999,vol.42,#16,p.3026-3032]

[2]CurrentPatentAssignee:ABBOTTLABORATORIESINC-US6670367,2003,B1Locationinpatent:Pagecolumn16

[3]CurrentPatentAssignee:ABBOTTLABORATORIESINC-US6670367,2003,B1Locationinpatent:Pagecolumn16

[4]Jansen;Knopp;Amberg;Bernard;Koser;Mueller;Muenster;Pfeiffer;Riechers[OrganicProcessResearchandDevelopment,2001,vol.5,#1,p.16-22]

[1]JournalofMedicinalChemistry,1999,vol.42,p.3026-3032

[2]Patent:US2011/263854,2011,A1

[1]Patent:WO2010/70658,2010,A2.Locationinpatent:Page/Pagecolumn20

[2]Patent:US2011/263854,2011,A1.Locationinpatent:Page/Pagecolumn8

[1]Patent:WO2013/57468,2013,A1.Locationinpatent:Page/Pagecolumn22-23

[2]Patent:WO2010/70658,2010,A2.Locationinpatent:Page/Pagecolumn23

[3]Patent:US2011/263854,2011,A1.Locationinpatent:Page/Pagecolumn9

Literature
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SDS
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Tags:177036-78-1 Molecular Formula|177036-78-1 MDL|177036-78-1 SMILES|177036-78-1 Methyl (2S)-2-hydroxy-3-methoxy-3,3-diphenylpropanoate