2-(4-Decyloxyphenyl)-5-carboxybenzooxazole
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Basic information
- Standard SMILES
CCCCCCCCCCOc1ccc(-c2nc3cc(C(=O)O)ccc3o2)cc1- InChIKey
FONSKJFIGBEZGR-UHFFFAOYSA-N- Molecular formula
- C24H29NO4
- Average molar mass
- 395.5 g/mol
Names & identifiers
- Preferred name
- 2-(4-Decyloxyphenyl)-5-carboxybenzooxazole
- IUPAC
- 2-(4-decoxyphenyl)-1,3-benzoxazole-5-carboxylic acid
Names & synonyms
SCHEMBL8308595FONSKJFIGBEZGR-UHFFFAOYSA-N2-(4-decyloxyphenyl)-5-carboxybenzooxazole
Database identifiers
- PubChem CID
- 19795409
Properties
Computed structural propertiesFilling in
- XLogP
- 7.4
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 478
Related reactions
4 records
Compound notes
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