(Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol

C15H28O3 — CID 59841793

IUPAC(Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol
SMILESCC1(CCCCC/C=C\CCCCO)OCCO1
InChIInChI=1S/C15H28O3/c1-15(17-13-14-18-15)11-9-7-5-3-2-4-6-8-10-12-16/h2,4,16H,3,5-14H2,1H3/b4-2-
InChIKeyKJCMFTMZXUNTOU-RQOWECAXSA-N
MW256.39 g/mol
LogP3.42
Rot. Bonds10

About (Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol

(Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol (PubChem CID 59841793) has the molecular formula C15H28O3 and a molecular weight of 256.39 g/mol. Its IUPAC name is (Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol.

Molecular Properties

Compound Name(Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol
PubChem CID59841793
Molecular FormulaC15H28O3
Molecular Weight256.39 g/mol
Exact Mass256.20
IUPAC Name(Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol
SMILESCC1(CCCCC/C=C\CCCCO)OCCO1
InChIInChI=1S/C15H28O3/c1-15(17-13-14-18-15)11-9-7-5-3-2-4-6-8-10-12-16/h2,4,16H,3,5-14H2,1H3/b4-2-
InChIKeyKJCMFTMZXUNTOU-RQOWECAXSA-N
XLogP3.42
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol?
The IUPAC name of (Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol (CID 59841793) is (Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol.
What is the SMILES notation for (Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol?
The canonical SMILES for (Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol is CC1(CCCCC/C=C\CCCCO)OCCO1.
What is the InChIKey of (Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol?
The InChIKey is KJCMFTMZXUNTOU-RQOWECAXSA-N. The full InChI is InChI=1S/C15H28O3/c1-15(17-13-14-18-15)11-9-7-5-3-2-4-6-8-10-12-16/h2,4,16H,3,5-14H2,1H3/b4-2-.
What are the key properties of (Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol?
(Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol has a molecular weight of 256.39 g/mol, XLogP of 3.42, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-11-(2-methyl-1,3-dioxolan-2-yl)undec-5-en-1-ol is sourced from PubChem (CID 59841793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).