(-)-4-{[1-(5,6,7,8-Tetrahydro-5,5,8,8-tetramethyl-2-naphthyl)ethyloxy]carbonyl}benzoic acid
Basic information
- Standard SMILES
CC(OC(=O)c1ccc(C(=O)O)cc1)c1ccc2c(c1)C(C)(C)CCC2(C)C- InChIKey
QHMOPZIZOBBDJY-UHFFFAOYSA-N- Molecular formula
- C24H28O4
- Average molar mass
- 380.5 g/mol
Names & identifiers
- Preferred name
- (-)-4-{[1-(5,6,7,8-Tetrahydro-5,5,8,8-tetramethyl-2-naphthyl)ethyloxy]carbonyl}benzoic acid
- IUPAC
- 4-[1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethoxycarbonyl]benzoic acid
Names & synonyms
CHEMBL97481SCHEMBL5083937QHMOPZIZOBBDJY-UHFFFAOYSA-N(-)-4-{[1-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthyl)ethyloxy]carbonyl}benzoic acid
Database identifiers
- PubChem CID
- 21474501
- ChEMBL
CHEMBL97481
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 585
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Related reactions
2 records
Compound notes
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