Basic information
- CAS
94134-39-1- Standard SMILES
CC(C)=CCC/C(C)=C/COC(O)C(O)Cc1ccccc1- InChIKey
UMLPGGUXQFSKHT-FOWTUZBSSA-N- Molecular formula
- C19H28O3
- Average molar mass
- 304.4 g/mol
- Monoisotopic mass
- 304.20384475
Names & identifiers
- Preferred name
- 1-((3,7-Dimethyl-2,6-octadienyl)oxy)-3-phenylpropane-1,2-diol
- IUPAC
- 1-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-phenylpropane-1,2-diol
Names & synonyms
EINECS 302-807-694134-39-11-((3,7-Dimethyl-2,6-octadienyl)oxy)-3-phenylpropane-1,2-diol1-[(3,7-DIMETHYL-2,6-OCTADIENYL)OXY]-3-PHENYLPROPANE-1,2-DIOLRefChem:222071302-807-6
Database identifiers
- CAS
94134-39-1- PubChem CID
- 6366451
- EC Number
- 302-807-6
- Nikkaji
- J368.227G
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 350
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: 1,2-Propanediol, 1-[(3,7-dimethyl-2,6-octadienyl)oxy]-3-phenyl-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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