Basic information
- CAS
7273-21-4- Standard SMILES
Cc1c2c(n(C)c1C)CCCC2=O- InChIKey
GXBFSPVRTYSDLI-UHFFFAOYSA-N- Molecular formula
- C11H15NO
- Average molar mass
- 177.24 g/mol
- Monoisotopic mass
- 177.1153641
Names & identifiers
- Preferred name
- 4H-Indol-4-one, 1,5,6,7-tetrahydro-1,2,3-trimethyl-
- IUPAC
- 1,2,3-trimethyl-6,7-dihydro-5H-indol-4-one
- English name
- 1,5,6,7-Tetrahydro-1,2,3-trimethyl-4H-indol-4-one
- Molecular weight
- 0
Names & synonyms
BRN 15272591,2,3-Trimethyl-4-oxo-4,5,6,7-tetrahydroindole7273-21-44H-INDOL-4-ONE, 1,5,6,7-TETRAHYDRO-1,2,3-TRIMETHYL-DTXSID30223028RefChem:297600DTXCID30145519AKOS0003202951,2,3-Trimethyl-1,5,6,7-tetrahydro-4H-indol-4-one1,5,6,7-Tetrahydro-1,2,3-trimethyl-4H-indol-4-one
Database identifiers
- CAS
7273-21-4- PubChem CID
- 23698
- DTXSID
DTXSID30223028- Nikkaji
- J68.762F
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 22 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 226
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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