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2777-58-4,MFCD00056193
Catalog No.:AA002UMV

2777-58-4 | Petroselinic acid methyl ester

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100mg
≥98%(GC)
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$97.00   $68.00
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500mg
98%(GC)
in stock  
$202.00   $142.00
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  • Technical Information
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  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002UMV
Chemical Name:
Petroselinic acid methyl ester
CAS Number:
2777-58-4
Molecular Formula:
C19H36O2
Molecular Weight:
296.4879
MDL Number:
MFCD00056193
SMILES:
CCCCCCCCCCC/C=C\CCCCC(=O)OC
Properties
Properties
 
BP:
208-210℃ (10 Torr)  
Form:
Liquid  
MP:
-1°C(lit.)  
Refractive Index:
1.4501 (589.3 nm 20℃)  
Storage:
-20 ℃;  

Computed Properties
 
Complexity:
246  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
16  
XLogP3:
7.6  

Downstream Synthesis Route
31253-08-4    2777-58-4   
3-((E)-Dodec-1-enyl)-2-methyl-octanedioicacid1-ethylester8-methylester 
 
5-(4-Methyl-5-oxo-3-undecyl-tetrahydro-furan-2-yl)-pentanoicacidmethylester 
 
5-(4-Methyl-5-oxo-2-undecyl-tetrahydro-furan-3-yl)-pentanoicacidmethylester 
 
(E)-2-Methyl-3-undecyl-non-4-enedioicacid1-ethylester9-methylester 

[1]Metzger,JuergenO.;Mahler,Ralf;Francke,Gerald[LiebigsAnnalen,1997,#11,p.2303-2313]

[1]Warwel,Siegfried;Bruese,Falk;Demes,Christoph;Kunz,Michael;Klaas,MarkRueschgen[Chemosphere,2001,vol.43,#1,p.39-48]

[1]Goyal,Sandeep;Banerjee,Shibdas;Mazumdar,Shyamalava[Biochemistry,2012,vol.51,#40,p.7880-7890]

2777-58-4    629-19-6   
C25H50O2S2 

[1]Knothe,Gerhard;Steidley,KevinR.[JournaloftheAmericanOilChemists'Society,2017,vol.94,#4,p.537-549]

Literature
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SDS
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