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1002101-19-0,MFCD24480577
Catalog No.:AA00016L

1002101-19-0 | Benzeneacetic acid, 3-pentyl-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$585.00   $410.00
- +
1g
95%
in stock  
$1,427.00   $999.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00016L
Chemical Name:
Benzeneacetic acid, 3-pentyl-
CAS Number:
1002101-19-0
Molecular Formula:
C13H18O2
Molecular Weight:
206.2808
MDL Number:
MFCD24480577
SMILES:
CCCCCc1cccc(c1)CC(=O)O
Properties
Computed Properties
 
Complexity:
189  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
6  
XLogP3:
4  

Downstream Synthesis Route

[1]Patent:WO2012/97427,2012,A1

[2]Patent:WO2016/54728,2016,A1

[3]Patent:WO2016/74068,2016,A1

Literature

Title: Fatty acid receptor modulator PBI-4050 inhibits kidney fibrosis and improves glycemic control.

Journal: JCI insight 20180517

Title: A Newly Discovered Antifibrotic Pathway Regulated by Two Fatty Acid Receptors: GPR40 and GPR84.

Journal: The American journal of pathology 20180501

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SDS
Tags:1002101-19-0 Molecular Formula|1002101-19-0 MDL|1002101-19-0 SMILES|1002101-19-0 Benzeneacetic acid, 3-pentyl-