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Home > Indoles and Oxindole > 120713-59-9
120713-59-9 | 2H-Indol-2-one, 3-ethyl-1,3-dihydro-5-hydroxy-1,3-dimethyl-
CAS No: 120713-59-9 Catalog No: AG00HFP1 MDL No:MFCD24720252
Product Description
Catalog Number:
AG00HFP1
Chemical Name:
2H-Indol-2-one, 3-ethyl-1,3-dihydro-5-hydroxy-1,3-dimethyl-
CAS Number:
120713-59-9
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
MDL Number:
MFCD24720252
IUPAC Name:
3-ethyl-5-hydroxy-1,3-dimethylindol-2-one
InChI:
InChI=1S/C12H15NO2/c1-4-12(2)9-7-8(14)5-6-10(9)13(3)11(12)15/h5-7,14H,4H2,1-3H3
InChI Key:
HXTZVERNCJVVLU-UHFFFAOYSA-N
SMILES:
CCC1(C)c2cc(O)ccc2N(C1=O)C
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.11g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.257g/mol
Monoisotopic Mass:
205.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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