Basic information
- CAS
72894-09-8- Standard SMILES
CC(C)=CCCC(C)CCOC(Cc1ccccc1)OCCc1ccccc1- InChIKey
IGYKWQDLCHIXTR-UHFFFAOYSA-N- Molecular formula
- C26H36O2
- Average molar mass
- 380.6 g/mol
- Monoisotopic mass
- 380.27153039
Names & identifiers
- Preferred name
- Benzene, (2-(1-((3,7-dimethyl-6-octen-1-yl)oxy)-2-phenylethoxy)ethyl)-
- IUPAC
- 2-[1-(3,7-dimethyloct-6-enoxy)-2-phenylethoxy]ethylbenzene
- English name
- [2-[1-[(3,7-dimethyl-6-octenyl)oxy]-2-phenylethoxy]ethyl]-benzene
- Molecular formula
- C26H36O2
- Molecular weight
- 380.57
Names & synonyms
Phenylacetaldehyde, citronellyl phenethyl acetalDTXSID10888230(2-(1-((3,7-Dimethyl-6-octenyl)oxy)-2-phenylethoxy)ethyl)benzeneBenzene, (2-(1-((3,7-dimethyl-6-octenyl)oxy)-2-phenylethoxy)ethyl)-Benzene, (2-(1-((3,7-dimethyl-6-octen-1-yl)oxy)-2-phenylethoxy)ethyl)-Benzene, [2-[1-[(3,7-dimethyl-6-octen-1-yl)oxy]-2-phenylethoxy]ethyl]-Benzene, [2-[1-[(3,7-dimethyl-6-octenyl)oxy]-2-phenylethoxy]ethyl]-[2-[1-[(3,7-Dimethyl-6-octenyl)oxy]-2-phenylethoxy]ethyl]benzeneRefChem:562099DTXCID60102751072894-09-8IGYKWQDLCHIXTR-UHFFFAOYSA-N
Show more names
[2-[1-[(3,7-dimethyl-6-octenyl)oxy]-2-phenylethoxy]ethyl]-Benzene1-[2-[1-[(3,7-Dimethyl-6-octenyl)oxy]-2-phenylethoxy]ethyl]benzene
(2-{1-[(3,7-Dimethyloct-6-en-1-yl)oxy]-2-phenylethoxy}ethyl)benzene
Properties
Computed structural properties
- XLogP
- 7.7
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 13
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 401
Physicochemical properties
- EPA Substance Registry System
- 2 · [2-[1-[(3,7-Dimethyl-6-octenyl)oxy]-2-phenylethoxy]ethyl]benzene (72894-09-8)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Benzene, [2-[1-[(3,7-dimethyl-6-octenyl)oxy]-2-phenylethoxy]ethyl]-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, [2-[1-[(3,7-dimethyl-6-octen-1-yl)oxy]-2-phenylethoxy]ethyl]-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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