Basic information
- Standard SMILES
COC(=O)Cc1ccccc1OCCCCOc1ccccc1- InChIKey
KHZQIUHQSFNDAJ-UHFFFAOYSA-N- Molecular formula
- C19H22O4
- Average molar mass
- 314.4 g/mol
- Monoisotopic mass
- 314.15180918
Names & identifiers
- Preferred name
- Methyl 2-(4-phenoxybut-1-yloxy)-phenylacetate
- IUPAC
- methyl 2-[2-(4-phenoxybutoxy)phenyl]acetate
Names & synonyms
SCHEMBL9798378KHZQIUHQSFNDAJ-UHFFFAOYSA-NMethyl 2-(4-phenoxybut-1-yloxy)-phenylacetate
Database identifiers
- PubChem CID
- 14550847
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 325
Related reactions
4 records
Compound notes
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