Home Other Building Blocks 7529-87-5
7529-87-5,MFCD09038538
Catalog No.:AA003S2T

7529-87-5 | Monoisopropyl fumarate

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Purity
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1g
>97%(GC)
in stock  
$45.00   $32.00
- +
5g
95%
in stock  
$87.00   $61.00
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25g
95%
in stock  
$203.00   $142.00
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100g
95%
in stock  
$594.00   $416.00
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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:
AA003S2T
Chemical Name:
Monoisopropyl fumarate
CAS Number:
7529-87-5
Molecular Formula:
C7H10O4
Molecular Weight:
158.1519
MDL Number:
MFCD09038538
SMILES:
CC(OC(=O)/C=C/C(=O)O)C
Properties
Properties
 
BP:
266.4°C at 760 mmHg  
Form:
Solid  
MP:
48 °C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
181  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
0.7  

Downstream Synthesis Route

[1]Schroeter,S.H.etal.[JustusLiebigsAnnalenderChemie,1966,vol.697,p.42-61]

1050510-84-3    7529-87-5   
C28H30F4O8 

[1]Itoh,Toshiyuki;Kanbara,Manabu;Ohashi,Masakazu;Hayase,Shuichi;Kawatsura,Motoi;Kato,Takashi;Miyazawa,Kazutoshi;Takagi,Yumiko;Uno,Hidemitsu[JournalofFluorineChemistry,2007,vol.128,#10,p.1112-1120]

7529-87-5   
(1R,3R)-1,3-bis(hydroxymethyl)-2,2-difluorocyclopropane 
 
C19H24F2O8 

[1]Itoh,Toshiyuki;Kanbara,Manabu;Ohashi,Masakazu;Hayase,Shuichi;Kawatsura,Motoi;Kato,Takashi;Miyazawa,Kazutoshi;Takagi,Yumiko;Uno,Hidemitsu[JournalofFluorineChemistry,2007,vol.128,#10,p.1112-1120]

7529-87-5    244640-66-2   
C22H26F4O8 

[1]Itoh,Toshiyuki;Kanbara,Manabu;Ohashi,Masakazu;Hayase,Shuichi;Kawatsura,Motoi;Kato,Takashi;Miyazawa,Kazutoshi;Takagi,Yumiko;Uno,Hidemitsu[JournalofFluorineChemistry,2007,vol.128,#10,p.1112-1120]

C18H22O4F4 
  7529-87-5   
C32H38F4O10 

[1]Itoh,Toshiyuki;Kanbara,Manabu;Ohashi,Masakazu;Hayase,Shuichi;Kawatsura,Motoi;Kato,Takashi;Miyazawa,Kazutoshi;Takagi,Yumiko;Uno,Hidemitsu[JournalofFluorineChemistry,2007,vol.128,#10,p.1112-1120]

Literature

Title: Structure-activity relationships of trans-substituted-propenoic acid derivatives on the nicotinic acid receptor HCA2 (GPR109A).

Journal: Bioorganic & medicinal chemistry letters 20110501

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SDS
Tags:7529-87-5 Molecular Formula|7529-87-5 MDL|7529-87-5 SMILES|7529-87-5 Monoisopropyl fumarate