Basic information
- Standard SMILES
Cc1ccc(CO)cc1OCCCCCCCCC1OCCO1- InChIKey
MRBBDQFVZQGQND-UHFFFAOYSA-N- Molecular formula
- C19H30O4
- Average molar mass
- 322.4 g/mol
Names & identifiers
- Preferred name
- (3-((8-(1,3-Dioxolan-2-yl)octyl)oxy)-4-methylphenyl)methanol
- IUPAC
- [3-[8-(1,3-dioxolan-2-yl)octoxy]-4-methylphenyl]methanol
Names & synonyms
SCHEMBL14166137MRBBDQFVZQGQND-UHFFFAOYSA-NDS-018224(3-((8-(1,3-dioxolan-2-yl)octyl)oxy)-4-methylphenyl)methanol1416069-46-9
Database identifiers
- PubChem CID
- 71093153
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 291
Related reactions
1 records
Compound notes
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