Home Carboxys 1H-Indole-5-carboxylicacid,6-amino-,ethylester(9CI)

1H-Indole-5-carboxylicacid,6-amino-,ethylester(9CI)

CAS No.:
174311-74-1
Catalog Number:
AG00B27T
Molecular Formula:
C11H12N2O2
Molecular Weight:
204.2252
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Product Description
Catalog Number:
AG00B27T
Chemical Name:
1H-Indole-5-carboxylicacid,6-amino-,ethylester(9CI)
CAS Number:
174311-74-1
Molecular Formula:
C11H12N2O2
Molecular Weight:
204.2252
MDL Number:
MFCD09751650
IUPAC Name:
ethyl 6-amino-1H-indole-5-carboxylate
InChI:
InChI=1S/C11H12N2O2/c1-2-15-11(14)8-5-7-3-4-13-10(7)6-9(8)12/h3-6,13H,2,12H2,1H3
InChI Key:
AYKVDBDWLMMDQY-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2cc[nH]c2cc1N
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.09g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
204.229g/mol
Monoisotopic Mass:
204.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties