3-oct-6-en-4-ylcyclopropene

C11H18 — CID 123690910

IUPAC3-oct-6-en-4-ylcyclopropene
SMILESCC=CCC(CCC)C1C=C1
InChIInChI=1S/C11H18/c1-3-5-7-10(6-4-2)11-8-9-11/h3,5,8-11H,4,6-7H2,1-2H3
InChIKeyMSWUZDSFUGJVPU-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.55
Rot. Bonds5

About 3-oct-6-en-4-ylcyclopropene

3-oct-6-en-4-ylcyclopropene (PubChem CID 123690910) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is 3-oct-6-en-4-ylcyclopropene.

Molecular Properties

Compound Name3-oct-6-en-4-ylcyclopropene
PubChem CID123690910
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name3-oct-6-en-4-ylcyclopropene
SMILESCC=CCC(CCC)C1C=C1
InChIInChI=1S/C11H18/c1-3-5-7-10(6-4-2)11-8-9-11/h3,5,8-11H,4,6-7H2,1-2H3
InChIKeyMSWUZDSFUGJVPU-UHFFFAOYSA-N
XLogP3.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

5-ethyloct-2-ene
CID 54276882
5-bromooct-2-ene
CID 57219131
5-ethenyloct-2-ene
CID 91485843
5-butylnon-2-ene
CID 175055679
acetylene;ethane;(Z,5S)-6-ethylnon-2-en-5-ol
CID 143066011
(Z)-2-propylhex-4-enoic acid
CID 59965143
(Z)-4-propyloct-6-en-3-amine
CID 89392102
trimethyl(oct-6-en-4-yloxy)silane
CID 57047258
(E,3R)-N-methoxy-N-methyl-3-propylhept-5-en-1-amine
CID 166735030
[(2E,8Z)-deca-2,8-dien-5-yl]cyclopentane
CID 163934301
6-methylnon-2-ene
CID 21361194
but-2-enyl(tributyl)phosphanium
CID 76527519

Frequently Asked Questions

What is the IUPAC name of 3-oct-6-en-4-ylcyclopropene?
The IUPAC name of 3-oct-6-en-4-ylcyclopropene (CID 123690910) is 3-oct-6-en-4-ylcyclopropene.
What is the SMILES notation for 3-oct-6-en-4-ylcyclopropene?
The canonical SMILES for 3-oct-6-en-4-ylcyclopropene is CC=CCC(CCC)C1C=C1.
What is the InChIKey of 3-oct-6-en-4-ylcyclopropene?
The InChIKey is MSWUZDSFUGJVPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18/c1-3-5-7-10(6-4-2)11-8-9-11/h3,5,8-11H,4,6-7H2,1-2H3.
What are the key properties of 3-oct-6-en-4-ylcyclopropene?
3-oct-6-en-4-ylcyclopropene has a molecular weight of 150.26 g/mol, XLogP of 3.55, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-oct-6-en-4-ylcyclopropene is sourced from PubChem (CID 123690910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).