3-(methoxymethoxy)oct-1-en-4-ol

C10H20O3 — CID 13025034

IUPAC3-(methoxymethoxy)oct-1-en-4-ol
SMILESC=CC(OCOC)C(O)CCCC
InChIInChI=1S/C10H20O3/c1-4-6-7-9(11)10(5-2)13-8-12-3/h5,9-11H,2,4,6-8H2,1,3H3
InChIKeyJYFWWSREHOLMCQ-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.71
Rot. Bonds8

About 3-(methoxymethoxy)oct-1-en-4-ol

3-(methoxymethoxy)oct-1-en-4-ol (PubChem CID 13025034) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is 3-(methoxymethoxy)oct-1-en-4-ol.

Molecular Properties

Compound Name3-(methoxymethoxy)oct-1-en-4-ol
PubChem CID13025034
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name3-(methoxymethoxy)oct-1-en-4-ol
SMILESC=CC(OCOC)C(O)CCCC
InChIInChI=1S/C10H20O3/c1-4-6-7-9(11)10(5-2)13-8-12-3/h5,9-11H,2,4,6-8H2,1,3H3
InChIKeyJYFWWSREHOLMCQ-UHFFFAOYSA-N
XLogP1.71
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 3-(methoxymethoxy)oct-1-en-4-ol with MolForge

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

Launch Full Analysis

Related Compounds

4-Penten-2-ol, 3-[(2-methoxyethoxy)methoxy]-, (2S,3S)-
CID 11424055
(E,4R,5S)-4-(methoxymethoxy)undec-2-en-5-ol
CID 10466412
(1S)-1-[(4S,5R)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]butan-1-ol
CID 11298584
(4S,5S)-5-(methoxymethoxy)undec-1-en-4-ol
CID 11322182
(4S,5S)-5-(2-methoxyethoxymethoxy)undec-1-en-4-ol
CID 11346374
(1R)-1-[(4R,5S)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]butan-1-ol
CID 11513947
4-(Methoxymethoxy)hex-5-en-3-ol
CID 12916897
4-(Methoxymethoxy)-2-methylhex-5-en-3-ol
CID 12916901
8,9-Dihydroxynon-1-en-3-yl methyl carbonate
CID 14142039
(4R,5S)-5-(methoxymethoxy)undec-1-en-4-ol
CID 16059325
(2S)-7-[(4S,5S)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]heptan-2-ol
CID 25018184
(2R,5R)-5-(methoxymethoxy)hept-6-en-2-ol
CID 44604186

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethoxy)oct-1-en-4-ol?
The IUPAC name of 3-(methoxymethoxy)oct-1-en-4-ol (CID 13025034) is 3-(methoxymethoxy)oct-1-en-4-ol.
What is the SMILES notation for 3-(methoxymethoxy)oct-1-en-4-ol?
The canonical SMILES for 3-(methoxymethoxy)oct-1-en-4-ol is C=CC(OCOC)C(O)CCCC.
What is the InChIKey of 3-(methoxymethoxy)oct-1-en-4-ol?
The InChIKey is JYFWWSREHOLMCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3/c1-4-6-7-9(11)10(5-2)13-8-12-3/h5,9-11H,2,4,6-8H2,1,3H3.
What are the key properties of 3-(methoxymethoxy)oct-1-en-4-ol?
3-(methoxymethoxy)oct-1-en-4-ol has a molecular weight of 188.27 g/mol, XLogP of 1.71, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethoxy)oct-1-en-4-ol is sourced from PubChem (CID 13025034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).