60390-47-8,MFCD18256626
Catalog No.:AA00EKHH

60390-47-8 | Ethyl 5-hydroxy-2-methylnicotinate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$109.00   $76.00
- +
250mg
97%
in stock  
$160.00   $112.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00EKHH
Chemical Name:
Ethyl 5-hydroxy-2-methylnicotinate
CAS Number:
60390-47-8
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
MDL Number:
MFCD18256626
SMILES:
Cc1ncc(cc1C(=O)OCC)O
Properties
Computed Properties
 
Complexity:
184  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.1  

Upstream Synthesis Route

[1]Patent:US2012/238751,2012,A1,.Locationinpatent:Page/Pagecolumn32

[2]Patent:WO2014/43272,2014,A1,.Locationinpatent:Paragraph0430;0434;0435

[1]JournaloftheAmericanChemicalSociety,1953,vol.75,p.738

[1]Patent:US2012/238751,2012,A1,

[2]Patent:WO2014/43272,2014,A1,

[1]Patent:US2012/238751,2012,A1,

[2]Patent:WO2014/43272,2014,A1,

Downstream Synthesis Route

[1]AngewandteChemie-InternationalEdition,2020,vol.59,p.22017-22022    Angew.Chem.,2020,vol.132,p.22201-22206,6

[2]JournaloftheAmericanChemicalSociety,1953,vol.75,p.738

[1]AngewandteChemie-InternationalEdition,2020,vol.59,p.22017-22022    Angew.Chem.,2020,vol.132,p.22201-22206,6

[2]Patent:US2012/238751,2012,A1.Locationinpatent:Page/Pagecolumn32-33

[1]Patent:US2012/238751,2012,A1

[2]Patent:WO2014/43272,2014,A1

[1]Patent:US2012/238751,2012,A1

[2]Patent:WO2014/43272,2014,A1

[1]Patent:US2012/238751,2012,A1.Locationinpatent:Page/Pagecolumn32

[2]Patent:WO2014/43272,2014,A1.Locationinpatent:Paragraph0430;0434;0435

Literature
Quotation Request
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Additional Info:
SDS
Historical Records
Tags:60390-47-8 Molecular Formula|60390-47-8 MDL|60390-47-8 SMILES|60390-47-8 Ethyl 5-hydroxy-2-methylnicotinate
Catalog No.: AA00EKHH
60390-47-8,MFCD18256626
60390-47-8 | Ethyl 5-hydroxy-2-methylnicotinate
Pack Size: 100mg
Purity: 97%
in stock
$109.00 $76.00
Pack Size: 250mg
Purity: 97%
in stock
$160.00 $112.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00EKHH
Chemical Name: Ethyl 5-hydroxy-2-methylnicotinate
CAS Number: 60390-47-8
Molecular Formula: C9H11NO3
Molecular Weight: 181.1885
MDL Number: MFCD18256626
SMILES: Cc1ncc(cc1C(=O)OCC)O
Properties
Complexity: 184  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.1  
Upstream Synthesis Route
99856-20-9    60390-47-8 

[1]Patent:US2012/238751,2012,A1,.Locationinpatent:Page/Pagecolumn32

[2]Patent:WO2014/43272,2014,A1,.Locationinpatent:Paragraph0430;0434;0435

60390-42-3    60390-47-8 

[1]JournaloftheAmericanChemicalSociety,1953,vol.75,p.738

1721-26-2    60390-47-8 

[1]Patent:US2012/238751,2012,A1,

[2]Patent:WO2014/43272,2014,A1,

31181-61-0    60390-47-8 

[1]Patent:US2012/238751,2012,A1,

[2]Patent:WO2014/43272,2014,A1,

Downstream Synthesis Route
60390-42-3    60390-47-8 

[1]AngewandteChemie-InternationalEdition,2020,vol.59,p.22017-22022    Angew.Chem.,2020,vol.132,p.22201-22206,6

[2]JournaloftheAmericanChemicalSociety,1953,vol.75,p.738

60390-47-8    18162-48-6    1400807-90-0 

[1]AngewandteChemie-InternationalEdition,2020,vol.59,p.22017-22022    Angew.Chem.,2020,vol.132,p.22201-22206,6

[2]Patent:US2012/238751,2012,A1.Locationinpatent:Page/Pagecolumn32-33

1721-26-2    60390-47-8 

[1]Patent:US2012/238751,2012,A1

[2]Patent:WO2014/43272,2014,A1

31181-61-0    60390-47-8 

[1]Patent:US2012/238751,2012,A1

[2]Patent:WO2014/43272,2014,A1

99856-20-9    60390-47-8 

[1]Patent:US2012/238751,2012,A1.Locationinpatent:Page/Pagecolumn32

[2]Patent:WO2014/43272,2014,A1.Locationinpatent:Paragraph0430;0434;0435

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