Home Carboxys 1H-Indole-3-carboxylic acid, 2-amino-1-hydroxy-, ethyl ester

1H-Indole-3-carboxylic acid, 2-amino-1-hydroxy-, ethyl ester

CAS No.:
65547-91-3
Catalog Number:
AG006RHY
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
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Product Description
Catalog Number:
AG006RHY
Chemical Name:
1H-Indole-3-carboxylic acid, 2-amino-1-hydroxy-, ethyl ester
CAS Number:
65547-91-3
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
MDL Number:
MFCD30342459
IUPAC Name:
ethyl 2-amino-1-hydroxyindole-3-carboxylate
InChI:
InChI=1S/C11H12N2O3/c1-2-16-11(14)9-7-5-3-4-6-8(7)13(15)10(9)12/h3-6,15H,2,12H2,1H3
InChI Key:
YAWKYANZHHPEKX-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(N)n(c2c1cccc2)O
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.085g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
220.228g/mol
Monoisotopic Mass:
220.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
77.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties