1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene

C17H26O2 — CID 83938271

IUPAC1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene
SMILESCC/C=C\CC(CCC)c1cc(OC)ccc1OC
InChIInChI=1S/C17H26O2/c1-5-7-8-10-14(9-6-2)16-13-15(18-3)11-12-17(16)19-4/h7-8,11-14H,5-6,9-10H2,1-4H3/b8-7-
InChIKeyPLSRFJBYBJTVPT-FPLPWBNLSA-N
MW262.39 g/mol
LogP4.94
Rot. Bonds8

About 1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene

1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene (PubChem CID 83938271) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is 1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene.

Molecular Properties

Compound Name1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene
PubChem CID83938271
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene
SMILESCC/C=C\CC(CCC)c1cc(OC)ccc1OC
InChIInChI=1S/C17H26O2/c1-5-7-8-10-14(9-6-2)16-13-15(18-3)11-12-17(16)19-4/h7-8,11-14H,5-6,9-10H2,1-4H3/b8-7-
InChIKeyPLSRFJBYBJTVPT-FPLPWBNLSA-N
XLogP4.94
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-methoxy-3-[(Z)-non-6-en-4-yl]benzene
CID 83928970
1-(2,5-dimethoxyphenyl)butan-1-amine;hydrochloride
CID 86262898
4-tert-butyl-2-[(Z)-non-6-en-4-yl]-1-propoxybenzene
CID 83935649
1-methoxy-2-[(E)-oct-6-en-4-yl]benzene
CID 142273894
1-(2,5-dimethoxyphenyl)-2-propylpentan-1-ol
CID 82988193
2-(2,5-dimethoxyphenyl)hexan-3-amine
CID 83047231
N-[1-(2,5-dimethoxyphenyl)ethyl]pentan-2-amine
CID 43191466
2-methyl-1-[(Z)-non-6-en-4-yl]-4-phenoxybenzene
CID 83937295
(1S)-1-(2,5-dimethoxyphenyl)pentan-1-amine;hydrochloride
CID 171219764
2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene
CID 83938264
2-(1-chloropentyl)-1,4-dimethoxybenzene
CID 61084308
1-tert-butyl-2-methoxy-5-methyl-3-[(Z)-non-6-en-4-yl]benzene
CID 83942988

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene?
The IUPAC name of 1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene (CID 83938271) is 1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene.
What is the SMILES notation for 1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene?
The canonical SMILES for 1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene is CC/C=C\CC(CCC)c1cc(OC)ccc1OC.
What is the InChIKey of 1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene?
The InChIKey is PLSRFJBYBJTVPT-FPLPWBNLSA-N. The full InChI is InChI=1S/C17H26O2/c1-5-7-8-10-14(9-6-2)16-13-15(18-3)11-12-17(16)19-4/h7-8,11-14H,5-6,9-10H2,1-4H3/b8-7-.
What are the key properties of 1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene?
1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene has a molecular weight of 262.39 g/mol, XLogP of 4.94, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene is sourced from PubChem (CID 83938271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).