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Home > Indoles and Oxindole > 1368933-59-8
1368933-59-8 | 5-methoxy-3,7-dimethyl-2,3-dihydro-1H-indol-2-one
CAS No: 1368933-59-8 Catalog No: AG01ELP6 MDL No:MFCD21985045
Product Description
Catalog Number:
AG01ELP6
Chemical Name:
5-methoxy-3,7-dimethyl-2,3-dihydro-1H-indol-2-one
CAS Number:
1368933-59-8
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD21985045
IUPAC Name:
5-methoxy-3,7-dimethyl-1,3-dihydroindol-2-one
InChI:
InChI=1S/C11H13NO2/c1-6-4-8(14-3)5-9-7(2)11(13)12-10(6)9/h4-5,7H,1-3H3,(H,12,13)
InChI Key:
XKKDDGZPUYRAOA-UHFFFAOYSA-N
SMILES:
COc1cc2C(C)C(=O)Nc2c(c1)C
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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