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16820-37-4,MFCD04441560
Catalog No.:AA001XUN

16820-37-4 | 2-Benzofurancarboxylic acid, 3,6-dimethyl-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$60.00   $42.00
- +
250mg
95%
in stock  
$99.00   $70.00
- +
1g
95%
in stock  
$172.00   $120.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001XUN
Chemical Name:
2-Benzofurancarboxylic acid, 3,6-dimethyl-
CAS Number:
16820-37-4
Molecular Formula:
C11H10O3
Molecular Weight:
190.1953
MDL Number:
MFCD04441560
SMILES:
Cc1ccc2c(c1)oc(c2C)C(=O)O
Properties
Computed Properties
 
Complexity:
239  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.9  

Downstream Synthesis Route

[1]Clinton;Wilson[JournaloftheAmericanChemicalSociety,1951,vol.73,p.1852]

[2]Fries;Fickewirth[JustusLiebigsAnnalenderChemie,1908,vol.362,p.51]

[1]Fosteretal.[JournaloftheChemicalSociety,1948,p.2254,2258]

[1]Dey[JournaloftheChemicalSociety,1915,vol.107,p.1637]

[1]Al-Zghoul,KhadeejhH.;Salih,KifahS.M.;Ayoub,MikdadT.;Mubarak,MohammadS.[Heterocycles,2005,vol.65,#12,p.2937-2947]

[2]Fries;Fickewirth[JustusLiebigsAnnalenderChemie,1908,vol.362,p.51]

16820-37-4   
3,6-dimethyl-benzofuran-2-carboxylicacid-(2-dimethylamino-ethylester);hydrochloride 

[1]Clinton;Wilson[JournaloftheAmericanChemicalSociety,1951,vol.73,p.1852]CurrentPatentAssignee:BAYERAG-US2652399,1950,A

Literature
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SDS
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Tags:16820-37-4 Molecular Formula|16820-37-4 MDL|16820-37-4 SMILES|16820-37-4 2-Benzofurancarboxylic acid, 3,6-dimethyl-