1-[(3,7-Dimethyloct-6-en-1-yl)oxy]-3-methylbenzene
Basic information
- CAS
51113-55-4- Standard SMILES
CC(C)=CCCC(C)CCOc1cccc(C)c1- InChIKey
ALHUXPLJZZPGEO-UHFFFAOYSA-N- Molecular formula
- C17H26O
- Average molar mass
- 246.4 g/mol
- Monoisotopic mass
- 246.19836545
Names & identifiers
- Preferred name
- 1-[(3,7-Dimethyloct-6-en-1-yl)oxy]-3-methylbenzene
- IUPAC
- 1-(3,7-dimethyloct-6-enoxy)-3-methylbenzene
Names & synonyms
51113-55-4NSC1950851-[(3,7-dimethyloct-6-en-1-yl)oxy]-3-methylbenzeneDTXSID90307818NSC-195085
Database identifiers
- CAS
51113-55-4- PubChem CID
- 304153
- DTXSID
DTXSID90307818
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 240
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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