Home Carboxys 1H-Indole-7-carboxylic acid, ethyl ester

1H-Indole-7-carboxylic acid, ethyl ester

CAS No.:
205873-58-1
Catalog Number:
AG002ADV
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG002ADV
Chemical Name:
1H-Indole-7-carboxylic acid, ethyl ester
CAS Number:
205873-58-1
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD00238711
IUPAC Name:
ethyl 1H-indole-7-carboxylate
InChI:
InChI=1S/C11H11NO2/c1-2-14-11(13)9-5-3-4-8-6-7-12-10(8)9/h3-7,12H,2H2,1H3
InChI Key:
WZXGOHXFXHUJLR-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cccc2c1[nH]cc2
Properties
Complexity:
217  
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:
3  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties