Basic information
- Standard SMILES
CCCCCCc1ccc(OC)cc1- InChIKey
IAINKDPTJUTRFY-UHFFFAOYSA-N- Molecular formula
- C13H20O
- Average molar mass
- 192.3 g/mol
- Monoisotopic mass
- 192.15141526
Names & identifiers
- Preferred name
- 4-Hexylanisole
- IUPAC
- 1-hexyl-4-methoxybenzene
Names & synonyms
4-Hexylanisole1-Hexyl-4-methoxybenzene4-hexyl-1-methoxybenzene4-n-hexyl-1-methoxybenzene1-Hexyl-4-methoxybenzene #SCHEMBL1119461SCHEMBL2089568SCHEMBL2089570SCHEMBL9151393SCHEMBL9478216SCHEMBL10529611AKOS024377756
Show more names
ST51020993
Database identifiers
- PubChem CID
- 578599
- Nikkaji
- J1.301.989D
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 125
Related reactions
7 records
Compound notes
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