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101651-80-3 | 2H-Indol-2-one, 3-(2-aminopropyl)-1,3-dihydro-3-hydroxy-
CAS No: 101651-80-3 Catalog No: AG000533 MDL No:
Product Description
Catalog Number:
AG000533
Chemical Name:
2H-Indol-2-one, 3-(2-aminopropyl)-1,3-dihydro-3-hydroxy-
CAS Number:
101651-80-3
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
IUPAC Name:
3-(2-aminopropyl)-3-hydroxy-1H-indol-2-one
InChI:
InChI=1S/C11H14N2O2/c1-7(12)6-11(15)8-4-2-3-5-9(8)13-10(11)14/h2-5,7,15H,6,12H2,1H3,(H,13,14)
InChI Key:
PTLNOCZKIVWOBW-UHFFFAOYSA-N
SMILES:
CC(CC1(O)C(=O)Nc2c1cccc2)N
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
206.245g/mol
Monoisotopic Mass:
206.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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