Home Carboxys 4-Methyl-1H-indole-2-carboxylic acid methyl ester

4-Methyl-1H-indole-2-carboxylic acid methyl ester

CAS No.:
136831-13-5
Catalog Number:
AG0012FO
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$123
- +
1g
98%
In Stock USA
United States
$138
- +
5g
98%
In Stock USA
United States
$407
- +
10g
98%
In Stock USA
United States
$713
- +
Product Description
Catalog Number:
AG0012FO
Chemical Name:
4-Methyl-1H-indole-2-carboxylic acid methyl ester
CAS Number:
136831-13-5
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD04966966
IUPAC Name:
methyl 4-methyl-1H-indole-2-carboxylate
InChI:
InChI=1S/C11H11NO2/c1-7-4-3-5-9-8(7)6-10(12-9)11(13)14-2/h3-6,12H,1-2H3
InChI Key:
JQTOCKRAYJKZOI-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2c([nH]1)cccc2C
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Literature
Title Journal
Synthesis of the 2,3,4-trisubstituted indole fragments of nosiheptide and glycothiohexide. Organic & biomolecular chemistry 20040307
Properties