2-methyl-4-non-8-enyloxolane

C14H26O — CID 71330222

IUPAC2-methyl-4-non-8-enyloxolane
SMILESC=CCCCCCCCC1COC(C)C1
InChIInChI=1S/C14H26O/c1-3-4-5-6-7-8-9-10-14-11-13(2)15-12-14/h3,13-14H,1,4-12H2,2H3
InChIKeyBYQHYQKVDMSTFO-UHFFFAOYSA-N
MW210.36 g/mol
LogP4.33
Rot. Bonds8

About 2-methyl-4-non-8-enyloxolane

2-methyl-4-non-8-enyloxolane (PubChem CID 71330222) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is 2-methyl-4-non-8-enyloxolane.

Molecular Properties

Compound Name2-methyl-4-non-8-enyloxolane
PubChem CID71330222
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name2-methyl-4-non-8-enyloxolane
SMILESC=CCCCCCCCC1COC(C)C1
InChIInChI=1S/C14H26O/c1-3-4-5-6-7-8-9-10-14-11-13(2)15-12-14/h3,13-14H,1,4-12H2,2H3
InChIKeyBYQHYQKVDMSTFO-UHFFFAOYSA-N
XLogP4.33
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 54.33
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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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-non-8-enyloxolane?
The IUPAC name of 2-methyl-4-non-8-enyloxolane (CID 71330222) is 2-methyl-4-non-8-enyloxolane.
What is the SMILES notation for 2-methyl-4-non-8-enyloxolane?
The canonical SMILES for 2-methyl-4-non-8-enyloxolane is C=CCCCCCCCC1COC(C)C1.
What is the InChIKey of 2-methyl-4-non-8-enyloxolane?
The InChIKey is BYQHYQKVDMSTFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-3-4-5-6-7-8-9-10-14-11-13(2)15-12-14/h3,13-14H,1,4-12H2,2H3.
What are the key properties of 2-methyl-4-non-8-enyloxolane?
2-methyl-4-non-8-enyloxolane has a molecular weight of 210.36 g/mol, XLogP of 4.33, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-non-8-enyloxolane is sourced from PubChem (CID 71330222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).