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6500-64-7,MFCD18072925
Catalog No.:AA00EICO

6500-64-7 | 5-(3-Methoxyphenyl)pentanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$439.00   $308.00
- +
1g
95%
in stock  
$1,022.00   $715.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00EICO
Chemical Name:
5-(3-Methoxyphenyl)pentanoic acid
CAS Number:
6500-64-7
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
MDL Number:
MFCD18072925
SMILES:
COc1cccc(c1)CCCCC(=O)O
Properties
Properties
 
BP:
371.1±25.0°C at 760 mmHg  
Form:
Liquid  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
191  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.5  

Downstream Synthesis Route

[1]Patent:WO2012/50848,2012,A1.Locationinpatent:Page/Pagecolumn115-116

[2]JournaloftheChemicalSociety.PerkintransactionsI,1984,p.2297-2304

[3]Patent:WO2019/109188,2019,A1.Locationinpatent:Paragraph00239

[4]Patent:CN107501061,2017,A.Locationinpatent:Paragraph0048;0055;0056

[5]Patent:US2012/130129,2012,A1.Locationinpatent:Page/Pagecolumn16

[6]MedChemComm,2012,vol.3,p.720-724

[7]BioorganicandMedicinalChemistry,2015,vol.23,p.7497-7520

[8]JournaloftheChemicalSocietyC:Organic,1966,p.990-994

[9]Tetrahedron,1972,vol.28,p.1083-1091

[10]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1981,vol.20,p.140-143

[11]JournalofOrganicChemistry,2013,vol.78,p.1718-1729

[12]JournalofAsianNaturalProductsResearch,2013,vol.15,p.840-848

[1]JournaloftheChemicalSociety.PerkintransactionsI,1992,p.1475-1482

[1]JournaloftheChemicalSociety.PerkintransactionsI,1992,p.1475-1482

[2]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1981,vol.20,p.140-143

[3]JournaloftheChemicalSociety.PerkinTransactions1(2001),2002,p.513-528

[1]JournalofHeterocyclicChemistry,1989,vol.26,p.365-369

[2]EuropeanJournalofOrganicChemistry,2016,vol.2016,p.3365-3372

[1]JournaloftheChemicalSocietyC:Organic,1966,p.990-994

[2]Journalofmedicinalchemistry,1972,vol.15,p.23-27

[3]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1981,vol.20,p.140-143

[4]JournalofAsianNaturalProductsResearch,2013,vol.15,p.840-848

Literature
Quotation Request
Company Name:
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Email:
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Quantity Required:
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Additional Info:
Submit
SDS
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Tags:6500-64-7 Molecular Formula|6500-64-7 MDL|6500-64-7 SMILES|6500-64-7 5-(3-Methoxyphenyl)pentanoic acid
Catalog No.: AA00EICO
6500-64-7,MFCD18072925
6500-64-7 | 5-(3-Methoxyphenyl)pentanoic acid
Pack Size： 250mg
Purity： 95%
in stock
$439.00 $308.00
Pack Size： 1g
Purity： 95%
in stock
$1,022.00 $715.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00EICO
Chemical Name: 5-(3-Methoxyphenyl)pentanoic acid
CAS Number: 6500-64-7
Molecular Formula: C12H16O3
Molecular Weight: 208.2536
MDL Number: MFCD18072925
SMILES: COc1cccc(c1)CCCCC(=O)O
Properties
BP: 371.1±25.0°C at 760 mmHg  
Form: Liquid  
Storage: Keep in dry area;Room Temperature;  
Complexity: 191  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.5  
Downstream Synthesis Route
6500-64-7    6500-65-8 

[1]Patent:WO2012/50848,2012,A1.Locationinpatent:Page/Pagecolumn115-116

[2]JournaloftheChemicalSociety.PerkintransactionsI,1984,p.2297-2304

[3]Patent:WO2019/109188,2019,A1.Locationinpatent:Paragraph00239

[4]Patent:CN107501061,2017,A.Locationinpatent:Paragraph0048;0055;0056

[5]Patent:US2012/130129,2012,A1.Locationinpatent:Page/Pagecolumn16

[6]MedChemComm,2012,vol.3,p.720-724

[7]BioorganicandMedicinalChemistry,2015,vol.23,p.7497-7520

[8]JournaloftheChemicalSocietyC:Organic,1966,p.990-994

[9]Tetrahedron,1972,vol.28,p.1083-1091

[10]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1981,vol.20,p.140-143

[11]JournalofOrganicChemistry,2013,vol.78,p.1718-1729

[12]JournalofAsianNaturalProductsResearch,2013,vol.15,p.840-848

6500-64-7    31129-95-0 

[1]JournaloftheChemicalSociety.PerkintransactionsI,1992,p.1475-1482

6500-64-7    143662-55-9 

[1]JournaloftheChemicalSociety.PerkintransactionsI,1992,p.1475-1482

[2]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1981,vol.20,p.140-143

[3]JournaloftheChemicalSociety.PerkinTransactions1(2001),2002,p.513-528

6500-64-7    123971-76-6 

[1]JournalofHeterocyclicChemistry,1989,vol.26,p.365-369

[2]EuropeanJournalofOrganicChemistry,2016,vol.2016,p.3365-3372

6500-63-6    6500-64-7 

[1]JournaloftheChemicalSocietyC:Organic,1966,p.990-994

[2]Journalofmedicinalchemistry,1972,vol.15,p.23-27

[3]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1981,vol.20,p.140-143

[4]JournalofAsianNaturalProductsResearch,2013,vol.15,p.840-848

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Submit
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