1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene

C18H28O2 — CID 102295508

IUPAC1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene
SMILESCCCCCCCC/C=C/c1cc(OC)cc(OC)c1
InChIInChI=1S/C18H28O2/c1-4-5-6-7-8-9-10-11-12-16-13-17(19-2)15-18(14-16)20-3/h11-15H,4-10H2,1-3H3/b12-11+
InChIKeyQDEANABHZABSRX-VAWYXSNFSA-N
MW276.42 g/mol
LogP5.47
Rot. Bonds10

About 1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene

1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene (PubChem CID 102295508) has the molecular formula C18H28O2 and a molecular weight of 276.42 g/mol. Its IUPAC name is 1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene.

Molecular Properties

Compound Name1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene
PubChem CID102295508
Molecular FormulaC18H28O2
Molecular Weight276.42 g/mol
Exact Mass276.21
IUPAC Name1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene
SMILESCCCCCCCC/C=C/c1cc(OC)cc(OC)c1
InChIInChI=1S/C18H28O2/c1-4-5-6-7-8-9-10-11-12-16-13-17(19-2)15-18(14-16)20-3/h11-15H,4-10H2,1-3H3/b12-11+
InChIKeyQDEANABHZABSRX-VAWYXSNFSA-N
XLogP5.47
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.42
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[(Z)-hept-1-enyl]-5-methoxyphenol;methane
CID 158001275
5-tridec-1-enylbenzene-1,3-diol
CID 71328262
5-[(E)-tetradec-1-enyl]benzene-1,3-diol
CID 102403768
5-oct-1-enylbenzene-1,3-diol
CID 54079025
1,3-dimethoxy-5-[(Z)-non-2-enyl]benzene
CID 101129319
1-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-3,5-dimethoxybenzene
CID 139077239
3-(3,5-dimethoxyphenyl)prop-2-en-1-ol
CID 71346140
[(E)-octadec-1-enyl]benzene
CID 22722345
1-[(Z)-hept-1-enyl]-4-methoxybenzene;1-iodo-4-methylbenzene
CID 159696317
2-[(E)-docos-1-enyl]naphthalene
CID 101307759
2-[(E)-dodec-1-enyl]naphthalene
CID 101304399
2-methyl-4-[(E)-tetradec-1-enyl]furan
CID 91799260

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene?
The IUPAC name of 1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene (CID 102295508) is 1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene.
What is the SMILES notation for 1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene?
The canonical SMILES for 1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene is CCCCCCCC/C=C/c1cc(OC)cc(OC)c1.
What is the InChIKey of 1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene?
The InChIKey is QDEANABHZABSRX-VAWYXSNFSA-N. The full InChI is InChI=1S/C18H28O2/c1-4-5-6-7-8-9-10-11-12-16-13-17(19-2)15-18(14-16)20-3/h11-15H,4-10H2,1-3H3/b12-11+.
What are the key properties of 1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene?
1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene has a molecular weight of 276.42 g/mol, XLogP of 5.47, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-dec-1-enyl]-3,5-dimethoxybenzene is sourced from PubChem (CID 102295508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).