4-Hydroxy-1-phenyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
Basic information
- CAS
7505-17-1- Standard SMILES
O=C(O)C1CC(O)c2ccccc2C1c1ccccc1- InChIKey
SKIRPCITJNHUGK-UHFFFAOYSA-N- Molecular formula
- C17H16O3
- Average molar mass
- 268.31 g/mol
- Monoisotopic mass
- 268.10994437
Names & identifiers
- Preferred name
- 4-Hydroxy-1-phenyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
- IUPAC
- 4-hydroxy-1-phenyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
Names & synonyms
7505-17-1NSC4048784-hydroxy-1-phenyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acidDTXSID50323791NSC-404878
Database identifiers
- CAS
7505-17-1- PubChem CID
- 346602
- DTXSID
DTXSID50323791
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 348
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Compound notes
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