Basic information
- CAS
69834-21-5- Standard SMILES
CCCCCCCCCCCCCCCCc1ccc(Oc2ccccc2)cc1CCCCCCCCCCCCCCCC- InChIKey
NIJNKCLSDJUGBQ-UHFFFAOYSA-N- Molecular formula
- C44H74O
- Average molar mass
- 619.1 g/mol
- Monoisotopic mass
- 618.57396698
Names & identifiers
- Preferred name
- Oxybis(hexadecylbenzene)
- IUPAC
- 1,2-dihexadecyl-4-phenoxybenzene
Names & synonyms
Oxybis(hexadecylbenzene)1,2-dihexadecyl-4-phenoxybenzeneDTXSID70867849NS00123758
Database identifiers
- CAS
69834-21-5- PubChem CID
- 112307
- DTXSID
DTXSID70867849- Nikkaji
- J154.585J
Properties
Computed structural properties
- XLogP
- 20.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 32
- Heavy atoms
- 45
- Formal charge
- 0
- Complexity
- 580
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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