2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene

C14H20O2 — CID 83938264

IUPAC2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene
SMILESC/C=C\CC(C)c1cc(OC)ccc1OC
InChIInChI=1S/C14H20O2/c1-5-6-7-11(2)13-10-12(15-3)8-9-14(13)16-4/h5-6,8-11H,7H2,1-4H3/b6-5-
InChIKeyXNEBATWWBOAHJS-WAYWQWQTSA-N
MW220.31 g/mol
LogP3.77
Rot. Bonds5

About 2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene

2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene (PubChem CID 83938264) has the molecular formula C14H20O2 and a molecular weight of 220.31 g/mol. Its IUPAC name is 2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene.

Molecular Properties

Compound Name2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene
PubChem CID83938264
Molecular FormulaC14H20O2
Molecular Weight220.31 g/mol
Exact Mass220.15
IUPAC Name2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene
SMILESC/C=C\CC(C)c1cc(OC)ccc1OC
InChIInChI=1S/C14H20O2/c1-5-6-7-11(2)13-10-12(15-3)8-9-14(13)16-4/h5-6,8-11H,7H2,1-4H3/b6-5-
InChIKeyXNEBATWWBOAHJS-WAYWQWQTSA-N
XLogP3.77
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 53.77
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

2-[(Z)-hex-4-en-2-yl]-1-methoxy-4-methylbenzene
CID 83933072
4-(2,5-dimethoxyphenyl)pentan-2-amine
CID 64720069
2-(2,5-dimethoxyphenyl)propanal
CID 596766
3-(2,4-dimethoxyphenyl)butanal
CID 83834095
2-(1-isocyanoethyl)-1,4-dimethoxybenzene
CID 4538904
3-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)butan-1-amine
CID 81016741
2-(dichloromethyl)-1,4-dimethoxybenzene
CID 23431965
(2S,3S)-3-(2,5-dimethoxyphenyl)butan-2-ol
CID 10420642
(1S)-1-(2,5-dimethoxyphenyl)-N-methylethanamine
CID 40516621
2-(1-bromo-2-methylbutyl)-1,4-dimethoxybenzene
CID 61084489
1,4-dimethoxy-2-[(Z)-non-6-en-4-yl]benzene
CID 83938271
(E)-N-[1-(2,4-dimethoxyphenyl)ethyl]pent-3-en-1-amine
CID 113348558

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene?
The IUPAC name of 2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene (CID 83938264) is 2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene.
What is the SMILES notation for 2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene?
The canonical SMILES for 2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene is C/C=C\CC(C)c1cc(OC)ccc1OC.
What is the InChIKey of 2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene?
The InChIKey is XNEBATWWBOAHJS-WAYWQWQTSA-N. The full InChI is InChI=1S/C14H20O2/c1-5-6-7-11(2)13-10-12(15-3)8-9-14(13)16-4/h5-6,8-11H,7H2,1-4H3/b6-5-.
What are the key properties of 2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene?
2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene has a molecular weight of 220.31 g/mol, XLogP of 3.77, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene is sourced from PubChem (CID 83938264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).