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5581-75-9,MFCD00014381
Catalog No.:AA003N95

5581-75-9 | 6-Phenylhexanoic acid

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Purity
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1g
98%
in stock  
$44.00   $31.00
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5g
98%
in stock  
$138.00   $96.00
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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:
AA003N95
Chemical Name:
6-Phenylhexanoic acid
CAS Number:
5581-75-9
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
MDL Number:
MFCD00014381
SMILES:
OC(=O)CCCCCc1ccccc1
NSC Number:
66179
Properties
Properties
 
BP:
319.2°C at 760 mmHg  
Form:
Liquid  
MP:
17-19℃  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
160  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
6  
XLogP3:
3.3  

Downstream Synthesis Route

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US5990102,1999,A

[2]v.Braun;Deutsch[ChemischeBerichte,1912,vol.45,p.2187]

[3]Staudinger;Mueller[ChemischeBerichte,1923,vol.56,p.713]

[4]Christol,H.;Plenat,F.[BulletindelaSocieteChimiquedeFrance,1962,p.1325-1331]Reinheckel,H.;Gensike,R.[JournalofOrganometallicChemistry,1968,vol.13,p.45-51]

[5]Protiva,Jiri;Pecka,Jaroslav;Klinotova,Eva;Prochazka,Milos[CollectionofCzechoslovakChemicalCommunications,1986,vol.51,#4,p.872-878]

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[1]Borsche[ChemischeBerichte,1919,vol.52,p.2079]

[2]Christol,H.;Plenat,F.[BulletindelaSocieteChimiquedeFrance,1962,p.1325-1331]

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[5]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US5135938,1992,A

[6]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US5143931,1992,A

[7]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US4730005,1988,A

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[9]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-EP296732,1991,B1

[10]Bach,Anders;Pizzirani,Daniela;Realini,Natalia;Vozella,Valentina;Russo,Debora;Penna,Ilaria;Melzig,Laurin;Scarpelli,Rita;Piomelli,Daniele[JournalofMedicinalChemistry,2015,vol.58,#23,p.9258-9272]

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[1]Lala,AnilK.;RaviKumar[JournaloftheAmericanChemicalSociety,1993,vol.115,#10,p.3982-3988]

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[1]Gapinski,D.Mark;Mallett,BarbaraE.;Froelich,LarryL.;Jackson,WilliamT.[JournalofMedicinalChemistry,1990,vol.33,#10,p.2807-2813]

[2]CurrentPatentAssignee:NOVARTISAG;Novartis(w/oSandoz)-US2017/88546,2017,A1Locationinpatent:Paragraph0395-0397

Literature

Title: Protective effects of 4-phenylbutyrate derivatives on the neuronal cell death and endoplasmic reticulum stress.

Journal: Biological & pharmaceutical bulletin 20120101

Title: Secondary metabolites from fungus Nigrospora sp.

Journal: Journal of Asian natural products research 20120101

Title: Poly-3-hydroxyalkanoate synthases from Pseudomonas putida U: substrate specificity and ultrastructural studies.

Journal: Microbial biotechnology 20080301

Title: Identification and properties of an inducible phenylacyl-CoA dehydrogenase in Pseudomonas putida KT2440.

Journal: FEMS microbiology letters 20070801

Title: Effects of chromophore orientation and molecule conformation on surface-enhanced Raman scattering studied with alkanoic acids and colloidal silver nanoparticles.

Journal: The Journal of chemical physics 20061221

Title: Induction and quantification of phenylacyl-CoA ligase enzyme activities in Pseudomonas putida CA-3 grown on aromatic carboxylic acids.

Journal: FEMS microbiology letters 20051015

Title: Bacterial synthesis of polyhydroxyalkanoates containing aromatic and aliphatic monomers by Pseudomonas putida CA-3.

Journal: International journal of biological macromolecules 20050401

Title: Naphthenic acids and surrogate naphthenic acids in methanogenic microcosms.

Journal: Water research 20010801

Title: Microbial synthesis of poly(beta-hydroxyalkanoates) bearing phenyl groups from pseudomonas putida: chemical structure and characterization.

Journal: Biomacromolecules 20010101

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Tags:5581-75-9 Molecular Formula|5581-75-9 MDL|5581-75-9 SMILES|5581-75-9 6-Phenylhexanoic acid