(1Z)-3-(2-ethenylphenoxy)cyclooctene

C16H20O — CID 10922278

IUPAC(1Z)-3-(2-ethenylphenoxy)cyclooctene
SMILESC=Cc1ccccc1OC1/C=C\CCCCC1
InChIInChI=1S/C16H20O/c1-2-14-10-8-9-13-16(14)17-15-11-6-4-3-5-7-12-15/h2,6,8-11,13,15H,1,3-5,7,12H2/b11-6-
InChIKeyPNUJTIOMAFDBJF-WDZFZDKYSA-N
MW228.33 g/mol
LogP4.60
Rot. Bonds3

About (1Z)-3-(2-ethenylphenoxy)cyclooctene

(1Z)-3-(2-ethenylphenoxy)cyclooctene (PubChem CID 10922278) has the molecular formula C16H20O and a molecular weight of 228.33 g/mol. Its IUPAC name is (1Z)-3-(2-ethenylphenoxy)cyclooctene.

Molecular Properties

Compound Name(1Z)-3-(2-ethenylphenoxy)cyclooctene
PubChem CID10922278
Molecular FormulaC16H20O
Molecular Weight228.33 g/mol
Exact Mass228.15
IUPAC Name(1Z)-3-(2-ethenylphenoxy)cyclooctene
SMILESC=Cc1ccccc1OC1/C=C\CCCCC1
InChIInChI=1S/C16H20O/c1-2-14-10-8-9-13-16(14)17-15-11-6-4-3-5-7-12-15/h2,6,8-11,13,15H,1,3-5,7,12H2/b11-6-
InChIKeyPNUJTIOMAFDBJF-WDZFZDKYSA-N
XLogP4.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.33
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1Z)-3-(2-ethenylphenoxy)cyclooctene?
The IUPAC name of (1Z)-3-(2-ethenylphenoxy)cyclooctene (CID 10922278) is (1Z)-3-(2-ethenylphenoxy)cyclooctene.
What is the SMILES notation for (1Z)-3-(2-ethenylphenoxy)cyclooctene?
The canonical SMILES for (1Z)-3-(2-ethenylphenoxy)cyclooctene is C=Cc1ccccc1OC1/C=C\CCCCC1.
What is the InChIKey of (1Z)-3-(2-ethenylphenoxy)cyclooctene?
The InChIKey is PNUJTIOMAFDBJF-WDZFZDKYSA-N. The full InChI is InChI=1S/C16H20O/c1-2-14-10-8-9-13-16(14)17-15-11-6-4-3-5-7-12-15/h2,6,8-11,13,15H,1,3-5,7,12H2/b11-6-.
What are the key properties of (1Z)-3-(2-ethenylphenoxy)cyclooctene?
(1Z)-3-(2-ethenylphenoxy)cyclooctene has a molecular weight of 228.33 g/mol, XLogP of 4.60, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-3-(2-ethenylphenoxy)cyclooctene is sourced from PubChem (CID 10922278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).