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42973-56-8,MFCD00060693
Catalog No.:AA00BYWZ

42973-56-8 | 2-Hydroxy-3-methoxyphenylacetonitrile

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1g
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$140.00   $98.00
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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:
AA00BYWZ
Chemical Name:
2-Hydroxy-3-methoxyphenylacetonitrile
CAS Number:
42973-56-8
Molecular Formula:
C9H9NO2
Molecular Weight:
163.1733
MDL Number:
MFCD00060693
SMILES:
N#CCc1cccc(c1O)OC
NSC Number:
291918
Properties
Properties
 
Form:
Solid  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
184  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.2  

Downstream Synthesis Route

[1]CurrentPatentAssignee:EXELIXISINC-WO2005/9389,2005,A2Locationinpatent:Page/Pagecolumn116

[1]OrganicLetters,2012,vol.14,p.5102-5105,4

[1]HelveticaChimicaActa,2013,vol.96,p.296-308

Literature

Title: Mechanism of simmondsin decomposition during sodium hydroxide treatment.

Journal: Journal of agricultural and food chemistry 20030226

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SDS
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