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38713-56-3,MFCD00016483
Catalog No.:AA003LGD

38713-56-3 | 4-Hydroxybenzoic acid n-nonyl ester

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Purity
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Price(USD)
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1g
98%(GC)
in stock  
$43.00   $30.00
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5g
98%(GC)
in stock  
$86.00   $60.00
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25g
>98.0%(T)(HPLC)
in stock  
$116.00   $81.00
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100g
>98.0%(T)(HPLC)
in stock  
$285.00   $200.00
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500g
>98.0%(T)(HPLC)
in stock  
$872.00   $611.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003LGD
Chemical Name:
4-Hydroxybenzoic acid n-nonyl ester
CAS Number:
38713-56-3
Molecular Formula:
C16H24O3
Molecular Weight:
264.3600
MDL Number:
MFCD00016483
SMILES:
CCCCCCCCCOC(=O)c1ccc(cc1)O
Properties
Properties
 
BP:
382.4°C at 760 mmHg  
Form:
Solid  
MP:
44 °C  
Refractive Index:
1.5400 (estimate)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
232  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
10  
XLogP3:
5.9  

Downstream Synthesis Route

[1]Neubert,M.E.;Leung,K.;Jirousek,M.R.;Ezenylimba,M.C.;Sabol-Keast,S.;etal.[MolecularCrystalsandLiquidCrystals(1969-1991),1991,vol.197,p.21-41]

[2]Nihei,Ken-Ichi;Nihei,Atsuko;Kubo,Isao[JournalofAgriculturalandFoodChemistry,2004,vol.52,#16,p.5011-5020]

[3]Nihei,Ken-Ichi;Nihei,Atsuko;Kubo,Isao[BioorganicandMedicinalChemistryLetters,2003,vol.13,#22,p.3993-3996]

[4]Neubert,M.E.;Keast,S.S.;Ezenyilimba,M.C.;Greer,P.B.;Jones,W.C.;etal.[MolecularCrystalsandLiquidCrystalsScienceandTechnology,SectionA:MolecularCrystalsandLiquidCrystals,1993,vol.237,p.47-68]

Literature

Title: Molecular design of antifungal agents.

Journal: Journal of agricultural and food chemistry 20020703

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SDS
Tags:38713-56-3 Molecular Formula|38713-56-3 MDL|38713-56-3 SMILES|38713-56-3 4-Hydroxybenzoic acid n-nonyl ester