Basic information
- CAS
797038-06-3- Standard SMILES
CCCc1ccc(Oc2ccccc2O)c(O)c1- InChIKey
BMJCPKXFEMWDDF-UHFFFAOYSA-N- Molecular formula
- C15H16O3
- Average molar mass
- 244.28 g/mol
- Monoisotopic mass
- 244.10994437
Names & identifiers
- Preferred name
- Phenol, 2-(2-hydroxyphenoxy)-5-propyl-
- IUPAC
- 2-(2-hydroxyphenoxy)-5-propylphenol
Names & synonyms
2-(2-hydroxyphenoxy)-5-propylphenolphenol, 2-(2-hydroxyphenoxy)-5-propyl-5-propyl-2-(2-hydroxyphenoxy)phenol797038-06-3PD205405BDBM3913DTXSID60349361PD 205405Phenol, 2-(2-hydroxyphenoxy)-5-propyl- (9CI)
Database identifiers
- CAS
797038-06-3- PubChem CID
- 644285
- DTXSID
DTXSID60349361- Nikkaji
- J2.106.667B
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 244
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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