Basic information
- CAS
76410-26-9- Standard SMILES
COc1ccc(-c2cc3c(n2C(C)C)CCCC3=O)cc1- InChIKey
JKMVSAGBAFCFLQ-UHFFFAOYSA-N- Molecular formula
- C18H21NO2
- Average molar mass
- 283.4 g/mol
- Monoisotopic mass
- 283.15722891
Names & identifiers
- Preferred name
- 4H-Indol-4-one, 1,5,6,7-tetrahydro-1-isopropyl-2-(p-methoxyphenyl)-
- IUPAC
- 2-(4-methoxyphenyl)-1-propan-2-yl-6,7-dihydro-5H-indol-4-one
- English name
- 1,5,6,7-Tetrahydro-1-isopropyl-2-(p-methoxyphenyl)-4H-indol-4-one
- Molecular weight
- 0
Names & synonyms
76410-26-9BRN 50789504H-INDOL-4-ONE, 1,5,6,7-TETRAHYDRO-1-ISOPROPYL-2-(p-METHOXYPHENYL)-1,5,6,7-Tetrahydro-1-isopropyl-2-(p-methoxyphenyl)-4H-indol-4-one1-Isopropyl-2-p-methoxyphenyl-4-oxo-4,5,6,7-tetrahydroindoleDTXSID10227241RefChem:297601DTXCID101497322-(4-Methoxyphenyl)-1-(propan-2-yl)-1,5,6,7-tetrahydro-4H-indol-4-one
Database identifiers
- CAS
76410-26-9- PubChem CID
- 53496
- DTXSID
DTXSID10227241- Nikkaji
- J68.760J
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 31.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 373
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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