3H-Indol-3-one, 1-acetyl-1,2-dihydro-2-methoxy-
Basic information
- CAS
87066-85-1- Standard SMILES
COC1C(=O)c2ccccc2N1C(C)=O- InChIKey
WFXSQCCFTHSZRC-UHFFFAOYSA-N- Molecular formula
- C11H11NO3
- Average molar mass
- 205.21 g/mol
- Monoisotopic mass
- 205.07389321
Names & identifiers
- Preferred name
- 3H-Indol-3-one, 1-acetyl-1,2-dihydro-2-methoxy-
- IUPAC
- 1-acetyl-2-methoxy-2H-indol-3-one
Names & synonyms
87066-85-1DTXSID903265893H-Indol-3-one, 1-acetyl-1,2-dihydro-2-methoxy-RefChem:283168DTXCID702777021-Acetyl-2-methoxyindolin-3-one1-acetyl-2-methoxy-1,2-dihydro-3H-indol-3-one1-acetyl-2-methoxy-2,3-dihydro-1H-indol-3-one1-acetyl-2-methoxy-2H-indol-3-oneNSC602885NSC-602885
Database identifiers
- CAS
87066-85-1- PubChem CID
- 353771
- DTXSID
DTXSID90326589- Nikkaji
- J1.076.849G
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 290
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Related reactions
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Compound notes
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