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1190319-90-4 | 2H-Indol-2-one, 5-amino-1,3-dihydro-3-hydroxy-3-methyl-
CAS No: 1190319-90-4 Catalog No: AG000HW9 MDL No:
Product Description
Catalog Number:
AG000HW9
Chemical Name:
2H-Indol-2-one, 5-amino-1,3-dihydro-3-hydroxy-3-methyl-
CAS Number:
1190319-90-4
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
IUPAC Name:
5-amino-3-hydroxy-3-methyl-1H-indol-2-one
InChI:
InChI=1S/C9H10N2O2/c1-9(13)6-4-5(10)2-3-7(6)11-8(9)12/h2-4,13H,10H2,1H3,(H,11,12)
InChI Key:
JIIZYEJEZAJAGG-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)C(C)(O)C(=O)N2
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
178.191g/mol
Monoisotopic Mass:
178.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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