tricyclo[5.4.0.02,8]undec-9-ene

C11H16 — CID 14143162

IUPACtricyclo[5.4.0.02,8]undec-9-ene
SMILESC1=CC2C3CCCCC2C3C1
InChIInChI=1S/C11H16/c1-2-5-9-10-6-3-7-11(9)8(10)4-1/h3,6,8-11H,1-2,4-5,7H2
InChIKeyUTNSWKMJYKCXSA-UHFFFAOYSA-N
MW148.25 g/mol
LogP3.00
Rot. Bonds

About tricyclo[5.4.0.02,8]undec-9-ene

tricyclo[5.4.0.02,8]undec-9-ene (PubChem CID 14143162) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is tricyclo[5.4.0.02,8]undec-9-ene.

Molecular Properties

Compound Nametricyclo[5.4.0.02,8]undec-9-ene
PubChem CID14143162
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Nametricyclo[5.4.0.02,8]undec-9-ene
SMILESC1=CC2C3CCCCC2C3C1
InChIInChI=1S/C11H16/c1-2-5-9-10-6-3-7-11(9)8(10)4-1/h3,6,8-11H,1-2,4-5,7H2
InChIKeyUTNSWKMJYKCXSA-UHFFFAOYSA-N
XLogP3.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 tricyclo[5.4.0.02,8]undec-9-ene?
The IUPAC name of tricyclo[5.4.0.02,8]undec-9-ene (CID 14143162) is tricyclo[5.4.0.02,8]undec-9-ene.
What is the SMILES notation for tricyclo[5.4.0.02,8]undec-9-ene?
The canonical SMILES for tricyclo[5.4.0.02,8]undec-9-ene is C1=CC2C3CCCCC2C3C1.
What is the InChIKey of tricyclo[5.4.0.02,8]undec-9-ene?
The InChIKey is UTNSWKMJYKCXSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16/c1-2-5-9-10-6-3-7-11(9)8(10)4-1/h3,6,8-11H,1-2,4-5,7H2.
What are the key properties of tricyclo[5.4.0.02,8]undec-9-ene?
tricyclo[5.4.0.02,8]undec-9-ene has a molecular weight of 148.25 g/mol, XLogP of 3.00, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tricyclo[5.4.0.02,8]undec-9-ene is sourced from PubChem (CID 14143162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).