1-ethenyl-4-hex-5-enoxybenzene

C14H18O — CID 86167911

IUPAC1-ethenyl-4-hex-5-enoxybenzene
SMILESC=CCCCCOc1ccc(C=C)cc1
InChIInChI=1S/C14H18O/c1-3-5-6-7-12-15-14-10-8-13(4-2)9-11-14/h3-4,8-11H,1-2,5-7,12H2
InChIKeyVFACUXRQPFHJDK-UHFFFAOYSA-N
MW202.30 g/mol
LogP4.06
Rot. Bonds7

About 1-ethenyl-4-hex-5-enoxybenzene

1-ethenyl-4-hex-5-enoxybenzene (PubChem CID 86167911) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-ethenyl-4-hex-5-enoxybenzene.

Molecular Properties

Compound Name1-ethenyl-4-hex-5-enoxybenzene
PubChem CID86167911
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name1-ethenyl-4-hex-5-enoxybenzene
SMILESC=CCCCCOc1ccc(C=C)cc1
InChIInChI=1S/C14H18O/c1-3-5-6-7-12-15-14-10-8-13(4-2)9-11-14/h3-4,8-11H,1-2,5-7,12H2
InChIKeyVFACUXRQPFHJDK-UHFFFAOYSA-N
XLogP4.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-ethenyl-4-[6-(4-ethenylphenoxy)hexoxy]benzene
CID 66919086
1-ethenyl-4-(4-iodobutoxy)benzene
CID 71412951
1-undec-10-enoxy-4-[(4-undec-10-enoxyphenyl)methyl]benzene
CID 132933254
1-methyl-4-tridec-12-enoxybenzene
CID 139447523
1-ethenyl-4-henicosoxybenzene
CID 174769675
1-ethenyl-4-[11-(4-methylphenoxy)undecoxy]benzene
CID 70667681
1-ethenyl-4-undecoxybenzene
CID 174770051
1-ethyl-4-oct-7-enoxybenzene
CID 158431404
11-(4-ethenylphenoxy)undecyl-trimethylazanium
CID 169121754
1-ethenyl-4-hept-4-enoxybenzene
CID 175065592
(4-non-8-enoxyphenyl)boronic acid
CID 142423597
3,5-bis(4-undec-10-enoxyphenyl)benzaldehyde
CID 102474145

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-4-hex-5-enoxybenzene?
The IUPAC name of 1-ethenyl-4-hex-5-enoxybenzene (CID 86167911) is 1-ethenyl-4-hex-5-enoxybenzene.
What is the SMILES notation for 1-ethenyl-4-hex-5-enoxybenzene?
The canonical SMILES for 1-ethenyl-4-hex-5-enoxybenzene is C=CCCCCOc1ccc(C=C)cc1.
What is the InChIKey of 1-ethenyl-4-hex-5-enoxybenzene?
The InChIKey is VFACUXRQPFHJDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O/c1-3-5-6-7-12-15-14-10-8-13(4-2)9-11-14/h3-4,8-11H,1-2,5-7,12H2.
What are the key properties of 1-ethenyl-4-hex-5-enoxybenzene?
1-ethenyl-4-hex-5-enoxybenzene has a molecular weight of 202.30 g/mol, XLogP of 4.06, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4-hex-5-enoxybenzene is sourced from PubChem (CID 86167911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).