1-(4-(Decyloxy)phenyl)ethanone
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Basic information
- CAS
18099-59-7- Standard SMILES
CCCCCCCCCCOc1ccc(C(C)=O)cc1- InChIKey
UVDHIFJLWNPHLV-UHFFFAOYSA-N- Molecular formula
- C18H28O2
- Average molar mass
- 276.4 g/mol
- Monoisotopic mass
- 276.20893013
Names & identifiers
- Preferred name
- 1-(4-(Decyloxy)phenyl)ethanone
- IUPAC
- 1-(4-decoxyphenyl)ethanone
- English name
- 4'-DECYLOXYACETOPHENONE
- Molecular formula
- C18H28O2
- Molecular weight
- 276.41
Names & synonyms
18099-59-71-(4-(Decyloxy)phenyl)ethanone1-(4-decoxyphenyl)ethanone4'-decyloxyacetophenone1-[4-(Decyloxy)phenyl]ethanone1-(4-(Decyloxy)phenyl)ethan-1-oneEthanone, 1-[4-(decyloxy)phenyl]-1-[4-(decyloxy)phenyl]ethan-1-one1-acetyl-4-decyloxybenzenep-Decyloxyacetophenone4-decyloxyacetophenone4'-(decyloxy)acetophenone
Show more names
4''-DECYLOXYACETOPHENONE 99%
AE-018/318600114'-Decyloxyacetophenone,99%SCHEMBL4443299DTXSID80342076Ethanone, 1-(4-decyloxyphenyl)-1-[4-(Decyloxy)phenyl]ethanone #CCG-52579SBB056589
Database identifiers
- CAS
18099-59-7- PubChem CID
- 578445
- DTXSID
DTXSID80342076
Properties
Computed structural propertiesFilling in
- XLogP
- 6.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 242
Physicochemical properties
- Melting point
- 35 · 35-37 °C
- Boiling point
- 379.32 °C · 379.32°C (rough estimate)
- Density
- 0.9804 · 0.9804 (rough estimate)
- refractive index
- 1.551 · 1.5510 (estimate)
- CAS DataBase Reference
- 18099 · 18099-59-7
- Safety Statements
- 24 · 24/25
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- safety_code
- 24/25
Related reactions
2 records
Compound notes
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