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53855-47-3,MFCD01863674
Catalog No.:AA00DBKK

53855-47-3 | Ethyl 2-methylindole-3-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$9.00   $7.00
- +
250mg
98%
in stock  
$12.00   $8.00
- +
1g
98%
in stock  
$14.00   $10.00
- +
5g
98%
in stock  
$66.00   $47.00
- +
10g
98%
in stock  
$131.00   $92.00
- +
25g
98%
in stock  
$326.00   $228.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DBKK
Chemical Name:
Ethyl 2-methylindole-3-carboxylate
CAS Number:
53855-47-3
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
MDL Number:
MFCD01863674
SMILES:
CCOC(=O)c1c(C)[nH]c2c1cccc2
Properties
Properties
 
BP:
344.1°C at 760 mmHg  
Form:
Solid  
MP:
134-136 °C(lit.);  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
242  
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:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.7  

Downstream Synthesis Route

[1]Patent:WO2012/80447,2012,A1.Locationinpatent:Page/Pagecolumn34

[2]Patent:US2013/267555,2013,A1.Locationinpatent:Paragraph0168;0171-0173

[3]JustusLiebigsAnnalenderChemie,1891,vol.266,p.75

[4]EuropeanJournalofOrganicChemistry,2009,p.531-546

[1]ChemischeBerichte,1931,vol.64,p.2636,2639

2-ethyl-3-phenylhydrazono-butyricacidethylester 
  53855-47-3 

[1]AmericanChemicalJournal,1894,vol.16,p.442

[1]JournalofOrganicChemistry,1989,vol.54,p.4785-4795

[1]JournalofOrganicChemistry,1989,vol.54,p.4785-4795

Literature
Quotation Request
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SDS
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Tags:53855-47-3 Molecular Formula|53855-47-3 MDL|53855-47-3 SMILES|53855-47-3 Ethyl 2-methylindole-3-carboxylate
Catalog No.: AA00DBKK
53855-47-3,MFCD01863674
53855-47-3 | Ethyl 2-methylindole-3-carboxylate
Pack Size： 100mg
Purity： 98%
in stock
$9.00 $7.00
Pack Size： 250mg
Purity： 98%
in stock
$12.00 $8.00
Pack Size： 1g
Purity： 98%
in stock
$14.00 $10.00
Pack Size： 5g
Purity： 98%
in stock
$66.00 $47.00
Pack Size： 10g
Purity： 98%
in stock
$131.00 $92.00
Pack Size： 25g
Purity： 98%
in stock
$326.00 $228.00
Quantity
- +
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Technical Information
Catalog Number: AA00DBKK
Chemical Name: Ethyl 2-methylindole-3-carboxylate
CAS Number: 53855-47-3
Molecular Formula: C12H13NO2
Molecular Weight: 203.2371
MDL Number: MFCD01863674
SMILES: CCOC(=O)c1c(C)[nH]c2c1cccc2
Properties
BP: 344.1°C at 760 mmHg  
Form: Solid  
MP: 134-136 °C(lit.);  
Storage: Keep in dry area;Room Temperature;  
Complexity: 242  
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: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.7  
Downstream Synthesis Route
6078-46-2    53855-47-3 

[1]Patent:WO2012/80447,2012,A1.Locationinpatent:Page/Pagecolumn34

[2]Patent:US2013/267555,2013,A1.Locationinpatent:Paragraph0168;0171-0173

[3]JustusLiebigsAnnalenderChemie,1891,vol.266,p.75

[4]EuropeanJournalofOrganicChemistry,2009,p.531-546

872270-34-3    141-52-6    53855-47-3 

[1]ChemischeBerichte,1931,vol.64,p.2636,2639

2-ethyl-3-phenylhydrazono-butyricacidethylester 
  53855-47-3 

[1]AmericanChemicalJournal,1894,vol.16,p.442

3587-60-8    53855-47-3    122946-62-7 

[1]JournalofOrganicChemistry,1989,vol.54,p.4785-4795

53855-47-3    34619-03-9    122946-64-9 

[1]JournalofOrganicChemistry,1989,vol.54,p.4785-4795

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