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5205-11-8,MFCD00036570
Catalog No.:AA003NZM

5205-11-8 | Benzoic acid 3-methyl-2-butenyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$54.00   $38.00
- +
5g
95%
in stock  
$112.00   $78.00
- +
25g
>98.0%(GC)
in stock  
$159.00   $112.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003NZM
Chemical Name:
Benzoic acid 3-methyl-2-butenyl ester
CAS Number:
5205-11-8
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
MDL Number:
MFCD00036570
SMILES:
O=C(c1ccccc1)OCC=C(C)C
FEMA Number:
4203
Properties
Properties
 
BP:
107 °C / 2.3mmHg  
Form:
Liquid  
Refractive Index:
1.5190-1.5210  

Computed Properties
 
Complexity:
208  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
4  
XLogP3:
3.2  

Downstream Synthesis Route

[1]Isayama,Shigeru;Mukaiyama,Teruaki[ChemistryLetters,1989,p.573-576]

[1]Isayama,Shigeru;Mukaiyama,Teruaki[ChemistryLetters,1989,p.1071-1074]

5205-11-8    694-53-1    5205-04-9   
C18H22O4Si 

[1]Isayama,Shigeru;Mukaiyama,Teruaki[ChemistryLetters,1989,p.1071-1074]

[1]Isayama,Shigeru;Mukaiyama,Teruaki[ChemistryLetters,1989,p.1071-1074]

[1]Tamaru,Yoshinao;Yasui,Kengo;Takanabe,Hidenobu;Tanaka,Shuji;Fugami,Keigo[AngewandteChemie,1992,vol.104,#5,p.662-664]

Literature

Title: Acetyltrimethylsilane, trifluoromethyltrimethylsilane, and prenyl esters: a three-component system for the synthesis of gem-difluoroanalogues of monoterpenes.

Journal: The Journal of organic chemistry 20010615

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SDS
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