3-Acetoxy-5-biphenyl-4-yl-pentanoic acid tert-butyl ester
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Basic information
- Standard SMILES
CC(=O)OC(CCc1ccc(-c2ccccc2)cc1)CC(=O)OC(C)(C)C- InChIKey
GLBFJTVIPSEQCR-UHFFFAOYSA-N- Molecular formula
- C23H28O4
- Average molar mass
- 368.5 g/mol
- Monoisotopic mass
- 368.19875937
Names & identifiers
- Preferred name
- 3-Acetoxy-5-biphenyl-4-yl-pentanoic acid tert-butyl ester
- IUPAC
- tert-butyl 3-acetyloxy-5-(4-phenylphenyl)pentanoate
Names & synonyms
SCHEMBL5613478GLBFJTVIPSEQCR-UHFFFAOYSA-N3-Acetoxy-5-biphenyl-4-yl-pentanoic acid tert-butyl ester
Database identifiers
- PubChem CID
- 58675129
Properties
Computed structural propertiesFilling in
- XLogP
- 4.9
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 465
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Related reactions
2 records
Compound notes
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