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473567-59-8,MFCD08058345
Catalog No.:AA00DFN8

473567-59-8 | Methyl (2S)-2-amino-3-(3,5-difluorophenyl)propanoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
96%
in stock  
$567.00   $397.00
- +
5g
96%
in stock  
$1,918.00 $1,343.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DFN8
Chemical Name:
Methyl (2S)-2-amino-3-(3,5-difluorophenyl)propanoate
CAS Number:
473567-59-8
Molecular Formula:
C10H11F2NO2
Molecular Weight:
215.1966
MDL Number:
MFCD08058345
SMILES:
COC(=O)[C@H](Cc1cc(F)cc(c1)F)N
Properties
Computed Properties
 
Complexity:
216  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.4  

Downstream Synthesis Route
potassiumdihydrogenphosphate 
  473567-47-4    473567-61-2    473567-59-8 

[1]CurrentPatentAssignee:PERRIGOCOMPANYPUBLICLIMITEDCOMPANY-US2003/4360,2003,A1

[1]Park,Heuisul;Min,Kyeongsik;Kwak,Hyo-Shin;Koo,KiDong;Lim,Dongchul;Seo,Sang-Won;Choi,Jae-Ung;Platt,Bettina;Choi,Deog-Young[BioorganicandMedicinalChemistryLetters,2008,vol.18,#9,p.2900-2904]

[2]CurrentPatentAssignee:LGCHEMCO.,LTD.-WO2009/38411,2009,A2Locationinpatent:Page/Pagecolumn35

[3]CurrentPatentAssignee:LGCHEMCO.,LTD.-WO2009/38412,2009,A2Locationinpatent:Page/Pagecolumn56

[1]CurrentPatentAssignee:LGCHEMCO.,LTD.-WO2009/38411,2009,A2Locationinpatent:Page/Pagecolumn34

[2]CurrentPatentAssignee:LGCHEMCO.,LTD.-WO2009/38412,2009,A2Locationinpatent:Page/Pagecolumn55-56

98-97-5    473567-59-8   
C15H13F2N3O3 

[1]Locationinpatent:experimentalpartMilo,LawrenceJ.;Lai,JackH.;Wu,Wengen;Liu,Yuxin;Maw,Hlaing;Li,Youhua;Jin,Zhiping;Shu,Ying;Poplawski,SarahE.;Wu,Yong;Sanford,DavidG.;Sudmeier,JamesL.;Bachovchin,WilliamW.[JournalofMedicinalChemistry,2011,vol.54,#13,p.4365-4377]

Literature
Quotation Request
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Additional Info:
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SDS
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Tags:473567-59-8 Molecular Formula|473567-59-8 MDL|473567-59-8 SMILES|473567-59-8 Methyl (2S)-2-amino-3-(3,5-difluorophenyl)propanoate
Catalog No.: AA00DFN8
473567-59-8,MFCD08058345
473567-59-8 | Methyl (2S)-2-amino-3-(3,5-difluorophenyl)propanoate
Pack Size： 1g
Purity： 96%
in stock
$567.00 $397.00
Pack Size： 5g
Purity： 96%
in stock
$1,918.00 $1,343.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00DFN8
Chemical Name: Methyl (2S)-2-amino-3-(3,5-difluorophenyl)propanoate
CAS Number: 473567-59-8
Molecular Formula: C10H11F2NO2
Molecular Weight: 215.1966
MDL Number: MFCD08058345
SMILES: COC(=O)[C@H](Cc1cc(F)cc(c1)F)N
Properties
Complexity: 216  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 1  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.4  
Downstream Synthesis Route
potassiumdihydrogenphosphate 
  473567-47-4    473567-61-2    473567-59-8 

[1]CurrentPatentAssignee:PERRIGOCOMPANYPUBLICLIMITEDCOMPANY-US2003/4360,2003,A1

24424-99-5    473567-59-8    473567-47-4 

[1]Park,Heuisul;Min,Kyeongsik;Kwak,Hyo-Shin;Koo,KiDong;Lim,Dongchul;Seo,Sang-Won;Choi,Jae-Ung;Platt,Bettina;Choi,Deog-Young[BioorganicandMedicinalChemistryLetters,2008,vol.18,#9,p.2900-2904]

[2]CurrentPatentAssignee:LGCHEMCO.,LTD.-WO2009/38411,2009,A2Locationinpatent:Page/Pagecolumn35

[3]CurrentPatentAssignee:LGCHEMCO.,LTD.-WO2009/38412,2009,A2Locationinpatent:Page/Pagecolumn56

1037222-60-8    473567-59-8 

[1]CurrentPatentAssignee:LGCHEMCO.,LTD.-WO2009/38411,2009,A2Locationinpatent:Page/Pagecolumn34

[2]CurrentPatentAssignee:LGCHEMCO.,LTD.-WO2009/38412,2009,A2Locationinpatent:Page/Pagecolumn55-56

98-97-5    473567-59-8   
C15H13F2N3O3 

[1]Locationinpatent:experimentalpartMilo,LawrenceJ.;Lai,JackH.;Wu,Wengen;Liu,Yuxin;Maw,Hlaing;Li,Youhua;Jin,Zhiping;Shu,Ying;Poplawski,SarahE.;Wu,Yong;Sanford,DavidG.;Sudmeier,JamesL.;Bachovchin,WilliamW.[JournalofMedicinalChemistry,2011,vol.54,#13,p.4365-4377]

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