Basic information
- CAS
52098-17-6- Standard SMILES
COCC(=O)c1cc2ccccc2n1C- InChIKey
VOTKMUXYVHDZPG-UHFFFAOYSA-N- Molecular formula
- C12H13NO2
- Average molar mass
- 203.24 g/mol
- Monoisotopic mass
- 203.09462866
Names & identifiers
- Preferred name
- Ketone, methoxymethyl 1-methyl-2-indolyl
- IUPAC
- 2-methoxy-1-(1-methylindol-2-yl)ethanone
Names & synonyms
KETONE, METHOXYMETHYL 1-METHYL-2-INDOLYL52098-17-6BRN 15318182-(Methoxyacetyl)-1-methylindoleMethoxymethyl 1-methyl-2-indolyl ketone2-methoxy-1-(1-methyl-1H-indol-2-yl)ethan-1-one1-methyl-2-methoxyacetylindoleDTXSID00200088
Database identifiers
- CAS
52098-17-6- PubChem CID
- 40229
- DTXSID
DTXSID00200088- Nikkaji
- J62.521C
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 31.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 242
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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