17369-59-4,MFCD00051813
Catalog No.:AA001Z1H

17369-59-4 | 3-Propylideneisobenzofuran-1(3H)-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
96% mixture of cis and trans isomers
in stock  
$6.00   $4.00
- +
5g
96% mixture of cis and trans isomers
in stock  
$8.00   $6.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA001Z1H
Chemical Name:
3-Propylideneisobenzofuran-1(3H)-one
CAS Number:
17369-59-4
Molecular Formula:
C11H10O2
Molecular Weight:
174.1959
MDL Number:
MFCD00051813
SMILES:
CCC=C1OC(=O)c2c1cccc2
FEMA Number:
2952
Properties
Properties
 
BP:
170 °C12 mm Hg(lit.)  
Form:
Liquid  
MP:
5 °C(lit.)  
Refractive Index:
n20/D 1.586(lit.)  

Computed Properties
 
Complexity:
243  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
1  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.6  

Downstream Synthesis Route

[1]Bromberg[ChemischeBerichte,1896,vol.29,p.1436]

[2]Tasman[RecueildesTravauxChimiquesdesPays-Bas,1927,vol.46,p.661,923]

[3]Mowryetal.[JournaloftheAmericanChemicalSociety,1949,vol.71,p.120]Ullyot;Taylor;Dawson[JournaloftheAmericanChemicalSociety,1948,vol.70,p.542,544]

[1]Kariyone;Shimizu[YakugakuZasshi/JournalofthePharmaceuticalSocietyofJapan,1953,vol.73,p.336][Chem.Abstr.,1954,p.2661]

17369-59-4    84-11-7   
3-ethyl-spirophenanthro9,10-<i>b</i>1,4dioxin-2,1'-phthalan-3'-one 

[1]Mustafa[JournaloftheChemicalSociety,1951,p.1034,1036]

[1]Liu,Bin;Zhou,Xigeng[ChineseChemicalLetters,2019,vol.30,#3,p.725-728]

[2]Berlingozzi;Cione[GazzettaChimicaItaliana,1927,vol.57,p.247][GazzettaChimicaItaliana,1927,vol.57,p.254]Tasman[RecueildesTravauxChimiquesdesPays-Bas,1927,vol.46,p.661,923]

[3]Ranade,VidyadharS.;Consiglio,Giambattista;Prins,Roel[JournalofOrganicChemistry,2000,vol.65,#4,p.1132-1138]

[1]Bromberg[ChemischeBerichte,1896,vol.29,p.1436]

[2]Yasueetal.[Nagoya-shiritsuDaigakuYakugakubuKiyo,1954,vol.2,p.53][Chem.Abstr.,1956,p.12063]

Literature

Title: Synthesis, resolution, and antiplatelet activity of 3-substituted 1(3H)-isobenzofuranone.

Journal: Bioorganic & medicinal chemistry letters 20070915

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SDS
Tags:17369-59-4 Molecular Formula|17369-59-4 MDL|17369-59-4 SMILES|17369-59-4 3-Propylideneisobenzofuran-1(3H)-one
Catalog No.: AA001Z1H
17369-59-4,MFCD00051813
17369-59-4 | 3-Propylideneisobenzofuran-1(3H)-one
Pack Size: 1g
Purity: 96% mixture of cis and trans isomers
in stock
$6.00 $4.00
Pack Size: 5g
Purity: 96% mixture of cis and trans isomers
in stock
$8.00 $6.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA001Z1H
Chemical Name: 3-Propylideneisobenzofuran-1(3H)-one
CAS Number: 17369-59-4
Molecular Formula: C11H10O2
Molecular Weight: 174.1959
MDL Number: MFCD00051813
SMILES: CCC=C1OC(=O)c2c1cccc2
FEMA Number: 2952
Properties
BP: 170 °C12 mm Hg(lit.)  
Form: Liquid  
MP: 5 °C(lit.)  
Refractive Index: n20/D 1.586(lit.)  
Complexity: 243  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 1  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.6  
Downstream Synthesis Route
106-31-0    85-44-9    17369-59-4 

[1]Bromberg[ChemischeBerichte,1896,vol.29,p.1436]

[2]Tasman[RecueildesTravauxChimiquesdesPays-Bas,1927,vol.46,p.661,923]

[3]Mowryetal.[JournaloftheAmericanChemicalSociety,1949,vol.71,p.120]Ullyot;Taylor;Dawson[JournaloftheAmericanChemicalSociety,1948,vol.70,p.542,544]

85-44-9    5905-48-6    17369-59-4 

[1]Kariyone;Shimizu[YakugakuZasshi/JournalofthePharmaceuticalSocietyofJapan,1953,vol.73,p.336][Chem.Abstr.,1954,p.2661]

17369-59-4    84-11-7   
3-ethyl-spirophenanthro9,10-<i>b</i>1,4dioxin-2,1'-phthalan-3'-one 

[1]Mustafa[JournaloftheChemicalSociety,1951,p.1034,1036]

17369-59-4    72424-08-9 

[1]Liu,Bin;Zhou,Xigeng[ChineseChemicalLetters,2019,vol.30,#3,p.725-728]

[2]Berlingozzi;Cione[GazzettaChimicaItaliana,1927,vol.57,p.247][GazzettaChimicaItaliana,1927,vol.57,p.254]Tasman[RecueildesTravauxChimiquesdesPays-Bas,1927,vol.46,p.661,923]

[3]Ranade,VidyadharS.;Consiglio,Giambattista;Prins,Roel[JournalofOrganicChemistry,2000,vol.65,#4,p.1132-1138]

17369-59-4    91350-27-5 

[1]Bromberg[ChemischeBerichte,1896,vol.29,p.1436]

[2]Yasueetal.[Nagoya-shiritsuDaigakuYakugakubuKiyo,1954,vol.2,p.53][Chem.Abstr.,1956,p.12063]

Literature fold

Title: Synthesis, resolution, and antiplatelet activity of 3-substituted 1(3H)-isobenzofuranone.

Journal: Bioorganic & medicinal chemistry letters20070915

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