88038-94-2,MFCD00017335
Catalog No.:AA003LXA

88038-94-2 | 4-(4-N-Propylphenyl)benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$11.00   $8.00
- +
5g
98%
in stock  
$16.00   $12.00
- +
10g
98%
in stock  
$20.00   $14.00
- +
25g
98%
in stock  
$48.00   $34.00
- +
100g
98%
in stock  
$94.00   $66.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003LXA
Chemical Name:
4-(4-N-Propylphenyl)benzoic acid
CAS Number:
88038-94-2
Molecular Formula:
C16H16O2
Molecular Weight:
240.2970
MDL Number:
MFCD00017335
SMILES:
CCCc1ccc(cc1)c1ccc(cc1)C(=O)O
Properties
Properties
 
BP:
401.5°C at 760 mmHg  
Form:
Solid  
MP:
222-226 °C  
Refractive Index:
1.6000 (estimate)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
258  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
5  

Downstream Synthesis Route
106-44-5    88038-94-2   
4-(4-n-propylphenyl)-benzoicacid4'-methylphenylester 

[1]Patent:DE2535046,1977,A1    Chem.Abstr.,1977,vol.86    Chem.Abstr.,1977,vol.86

18979-50-5    88038-94-2   
4-(4-n-propylphenyl)-benzoicacid4'-n-propyloxyphenylester 

[1]Patent:DE2535046,1977,A1    Chem.Abstr.,1977,vol.86    Chem.Abstr.,1977,vol.86

13037-86-0    88038-94-2   
4-(4-n-propylphenyl)-benzoicacid4'-n-heptyloxyphenylester 

[1]Patent:DE2535046,1977,A1    Chem.Abstr.,1977,vol.86    Chem.Abstr.,1977,vol.86

[1]ZeitschriftfurNaturforschung,B:ChemicalSciences,2000,vol.55,p.567-575

[2]Patent:DE2535046,1977,    Chem.Abstr.,1977,vol.86

[1]Patent:FR2288732,1976,B1    Chem.Abstr.,1976,vol.85    Chem.Abstr.,1976,vol.85

[2]Patent:DE2535046,1977,A1    Chem.Abstr.,1977,vol.86    Chem.Abstr.,1977,vol.86

Literature

Title: Amphipathic benzoic acid derivatives: synthesis and binding in the hydrophobic tunnel of the zinc deacetylase LpxC.

Journal: Bioorganic & medicinal chemistry 20070401

Title: Discovery of a potent, orally available, and isoform-selective retinoic acid beta2 receptor agonist.

Journal: Journal of medicinal chemistry 20051201

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SDS
Tags:88038-94-2 Molecular Formula|88038-94-2 MDL|88038-94-2 SMILES|88038-94-2 4-(4-N-Propylphenyl)benzoic acid
Catalog No.: AA003LXA
88038-94-2,MFCD00017335
88038-94-2 | 4-(4-N-Propylphenyl)benzoic acid
Pack Size: 1g
Purity: 98%
in stock
$11.00 $8.00
Pack Size: 5g
Purity: 98%
in stock
$16.00 $12.00
Pack Size: 10g
Purity: 98%
in stock
$20.00 $14.00
Pack Size: 25g
Purity: 98%
in stock
$48.00 $34.00
Pack Size: 100g
Purity: 98%
in stock
$94.00 $66.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003LXA
Chemical Name: 4-(4-N-Propylphenyl)benzoic acid
CAS Number: 88038-94-2
Molecular Formula: C16H16O2
Molecular Weight: 240.2970
MDL Number: MFCD00017335
SMILES: CCCc1ccc(cc1)c1ccc(cc1)C(=O)O
Properties
BP: 401.5°C at 760 mmHg  
Form: Solid  
MP: 222-226 °C  
Refractive Index: 1.6000 (estimate)  
Storage: Keep in dry area;Room Temperature;  
Complexity: 258  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 18  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 5  
Downstream Synthesis Route
106-44-5    88038-94-2   
4-(4-n-propylphenyl)-benzoicacid4'-methylphenylester 

[1]Patent:DE2535046,1977,A1    Chem.Abstr.,1977,vol.86    Chem.Abstr.,1977,vol.86

18979-50-5    88038-94-2   
4-(4-n-propylphenyl)-benzoicacid4'-n-propyloxyphenylester 

[1]Patent:DE2535046,1977,A1    Chem.Abstr.,1977,vol.86    Chem.Abstr.,1977,vol.86

13037-86-0    88038-94-2   
4-(4-n-propylphenyl)-benzoicacid4'-n-heptyloxyphenylester 

[1]Patent:DE2535046,1977,A1    Chem.Abstr.,1977,vol.86    Chem.Abstr.,1977,vol.86

58743-76-3    88038-94-2 

[1]ZeitschriftfurNaturforschung,B:ChemicalSciences,2000,vol.55,p.567-575

[2]Patent:DE2535046,1977,    Chem.Abstr.,1977,vol.86

1805-61-4    88038-94-2    61733-25-3 

[1]Patent:FR2288732,1976,B1    Chem.Abstr.,1976,vol.85    Chem.Abstr.,1976,vol.85

[2]Patent:DE2535046,1977,A1    Chem.Abstr.,1977,vol.86    Chem.Abstr.,1977,vol.86

Literature fold

Title: Amphipathic benzoic acid derivatives: synthesis and binding in the hydrophobic tunnel of the zinc deacetylase LpxC.

Journal: Bioorganic & medicinal chemistry20070401

Title: Discovery of a potent, orally available, and isoform-selective retinoic acid beta2 receptor agonist.

Journal: Journal of medicinal chemistry20051201

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