2-[5-[(5-Oxo-2-propyl-5,6,7,8-tetrahydro-1-naphthalenyl)oxy]pentyloxy]benzenepropanoic acid
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CCCc1ccc2c(c1OCCCCCOc1ccccc1CCC(=O)O)CCCC2=O- InChIKey
LVHYPTSZBBGAHK-UHFFFAOYSA-N- Molecular formula
- C27H34O5
- Average molar mass
- 438.6 g/mol
Names & identifiers
- Preferred name
- 2-[5-[(5-Oxo-2-propyl-5,6,7,8-tetrahydro-1-naphthalenyl)oxy]pentyloxy]benzenepropanoic acid
- IUPAC
- 3-[2-[5-[(5-oxo-2-propyl-7,8-dihydro-6H-naphthalen-1-yl)oxy]pentoxy]phenyl]propanoic acid
Names & synonyms
SCHEMBL9119934LVHYPTSZBBGAHK-UHFFFAOYSA-N2-[5-[(5-oxo-2-propyl-5,6,7,8-tetrahydro-1-naphthalenyl)oxy]pentyloxy]benzenepropanoic acid
Database identifiers
- PubChem CID
- 19922017
Properties
Computed structural propertiesFilling in
- XLogP
- 5.8
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 576
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
3 records
Compound notes
Loading…