1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene

C14H20O — CID 83932237

IUPAC1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene
SMILESC/C=C\CC(C)c1ccc(OCC)cc1
InChIInChI=1S/C14H20O/c1-4-6-7-12(3)13-8-10-14(11-9-13)15-5-2/h4,6,8-12H,5,7H2,1-3H3/b6-4-
InChIKeyYXFAFNDKOHHJFE-XQRVVYSFSA-N
MW204.31 g/mol
LogP4.16
Rot. Bonds5

About 1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene

1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene (PubChem CID 83932237) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene.

Molecular Properties

Compound Name1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene
PubChem CID83932237
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene
SMILESC/C=C\CC(C)c1ccc(OCC)cc1
InChIInChI=1S/C14H20O/c1-4-6-7-12(3)13-8-10-14(11-9-13)15-5-2/h4,6,8-12H,5,7H2,1-3H3/b6-4-
InChIKeyYXFAFNDKOHHJFE-XQRVVYSFSA-N
XLogP4.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-[(Z)-hex-4-en-2-yl]-4-hexoxybenzene
CID 83932735
1-ethoxy-4-(4-methylpentan-2-yl)benzene
CID 57011514
[(1S)-1-(4-ethoxyphenyl)ethyl]azanium chloride
CID 89251854
1-[(Z)-hex-4-en-2-yl]-2-methyl-4-propoxybenzene
CID 83936914
1-ethoxy-4-[(E)-pent-3-enyl]benzene
CID 22095339
2-(4-ethoxyphenyl)propanedial
CID 3698706
2-amino-5-(4-ethoxyphenyl)hexan-3-ol
CID 83932254
2-[4-[(4-ethoxyphenoxy)methyl]phenyl]propan-1-amine
CID 105350465
1-ethoxy-4-[(Z)-prop-1-enoxy]benzene
CID 101144110
2-[(Z)-hex-4-en-2-yl]-1,4-dimethoxybenzene
CID 83938264
1,3-difluoro-2-[(Z)-hex-4-en-2-yl]benzene
CID 83925405
1-(1-bromo-2-methylbutyl)-4-ethoxybenzene
CID 63436936

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene?
The IUPAC name of 1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene (CID 83932237) is 1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene.
What is the SMILES notation for 1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene?
The canonical SMILES for 1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene is C/C=C\CC(C)c1ccc(OCC)cc1.
What is the InChIKey of 1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene?
The InChIKey is YXFAFNDKOHHJFE-XQRVVYSFSA-N. The full InChI is InChI=1S/C14H20O/c1-4-6-7-12(3)13-8-10-14(11-9-13)15-5-2/h4,6,8-12H,5,7H2,1-3H3/b6-4-.
What are the key properties of 1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene?
1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene has a molecular weight of 204.31 g/mol, XLogP of 4.16, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene is sourced from PubChem (CID 83932237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).