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50501-07-0

50501-07-0 | Ethyl indoline-2-carboxylate

CAS No: 50501-07-0 Catalog No: AG003R0C MDL No:MFCD06797114

Product Description

Catalog Number:
AG003R0C
Chemical Name:
Ethyl indoline-2-carboxylate
CAS Number:
50501-07-0
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD06797114
IUPAC Name:
ethyl 2,3-dihydro-1H-indole-2-carboxylate
InChI:
InChI=1S/C11H13NO2/c1-2-14-11(13)10-7-8-5-3-4-6-9(8)12-10/h3-6,10,12H,2,7H2,1H3
InChI Key:
KISPUTPAKVZNBI-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1Cc2c(N1)cccc2

Properties

Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

Literature

Title Journal
Cardioselective anti-ischemic ATP-sensitive potassium channel (KATP) openers: benzopyranyl indoline and indole analogues. European journal of medicinal chemistry 20030501

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