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1199-20-8,MFCD00053500
Catalog No.:AA000PRA

1199-20-8 | 3-phenylbut-2-enoic acid (E/Z mixture)

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$208.00   $145.00
- +
1g
95%
in stock  
$422.00   $295.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA000PRA
Chemical Name:
3-phenylbut-2-enoic acid (E/Z mixture)
CAS Number:
1199-20-8
Molecular Formula:
C10H10O2
Molecular Weight:
162.1852
MDL Number:
MFCD00053500
SMILES:
CC(=CC(=O)O)c1ccccc1
Properties
Computed Properties
 
Complexity:
188  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.5  

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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