Basic information
- Standard SMILES
COc1cc2c(cc1C=O)C(C)(C)CCC2(C)C- InChIKey
PNGXABSROSUIBV-UHFFFAOYSA-N- Molecular formula
- C16H22O2
- Average molar mass
- 246.34 g/mol
- Monoisotopic mass
- 246.16197994
Names & identifiers
- Preferred name
- 2-Formyl-5,6,7,8-tetrahydro-3-methoxy-5,5,8,8tetramethylnaphthalene
- IUPAC
- 3-methoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde
Names & synonyms
SCHEMBL7713216PNGXABSROSUIBV-UHFFFAOYSA-N5,6,7,8-tetrahydro-3-methoxy5,5,8,8-tetramethyl-2-naphthaldehyde2-formyl-5,6,7,8-tetrahydro-3-methoxy-5,5,8,8-tetramethylnaphthalene2-formyl-5,6,7,8-tetrahydro-3-methoxy-5,5,8,8tetramethylnaphthalene5,6,7,8-tetrah-ydro-3-methoxy-5,5,8,8-tetramethyl-2-naphthaldehyde5,6,7,8-tetrahydro-3-methoxy-5,5,8,8-tetramethyl-2-naphthaldehyde
Database identifiers
- PubChem CID
- 14726522
- Nikkaji
- J592.246A
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 319
Related reactions
11 records
Compound notes
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