1-Methoxy-4-pentadecylbenzene
Basic information
- CAS
22165-08-8- Standard SMILES
CCCCCCCCCCCCCCCc1ccc(OC)cc1- InChIKey
UQIRCMQIXDHIKQ-UHFFFAOYSA-N- Molecular formula
- C22H38O
- Average molar mass
- 318.5 g/mol
- Monoisotopic mass
- 318.29226583
Names & identifiers
- Preferred name
- 1-Methoxy-4-pentadecylbenzene
- IUPAC
- 1-methoxy-4-pentadecylbenzene
Names & synonyms
NSC22960222165-08-81-methoxy-4-pentadecylbenzeneSCHEMBL3220290DTXSID60310657NSC-229602
Database identifiers
- CAS
22165-08-8- PubChem CID
- 313887
- DTXSID
DTXSID60310657
Properties
Computed structural properties
- XLogP
- 9.5
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 15
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 230
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…