(Z)-6-(methoxymethoxy)hex-4-en-1-ol

C8H16O3 — CID 10511158

IUPAC(Z)-6-(methoxymethoxy)hex-4-en-1-ol
SMILESCOCOC/C=C\CCCO
InChIInChI=1S/C8H16O3/c1-10-8-11-7-5-3-2-4-6-9/h3,5,9H,2,4,6-8H2,1H3/b5-3-
InChIKeyHPEDRFSNFYLZLK-HYXAFXHYSA-N
MW160.21 g/mol
LogP0.94
Rot. Bonds7

About (Z)-6-(methoxymethoxy)hex-4-en-1-ol

(Z)-6-(methoxymethoxy)hex-4-en-1-ol (PubChem CID 10511158) has the molecular formula C8H16O3 and a molecular weight of 160.21 g/mol. Its IUPAC name is (Z)-6-(methoxymethoxy)hex-4-en-1-ol.

Molecular Properties

Compound Name(Z)-6-(methoxymethoxy)hex-4-en-1-ol
PubChem CID10511158
Molecular FormulaC8H16O3
Molecular Weight160.21 g/mol
Exact Mass160.11
IUPAC Name(Z)-6-(methoxymethoxy)hex-4-en-1-ol
SMILESCOCOC/C=C\CCCO
InChIInChI=1S/C8H16O3/c1-10-8-11-7-5-3-2-4-6-9/h3,5,9H,2,4,6-8H2,1H3/b5-3-
InChIKeyHPEDRFSNFYLZLK-HYXAFXHYSA-N
XLogP0.94
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.21
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-6-(methoxymethoxy)hex-4-en-1-ol?
The IUPAC name of (Z)-6-(methoxymethoxy)hex-4-en-1-ol (CID 10511158) is (Z)-6-(methoxymethoxy)hex-4-en-1-ol.
What is the SMILES notation for (Z)-6-(methoxymethoxy)hex-4-en-1-ol?
The canonical SMILES for (Z)-6-(methoxymethoxy)hex-4-en-1-ol is COCOC/C=C\CCCO.
What is the InChIKey of (Z)-6-(methoxymethoxy)hex-4-en-1-ol?
The InChIKey is HPEDRFSNFYLZLK-HYXAFXHYSA-N. The full InChI is InChI=1S/C8H16O3/c1-10-8-11-7-5-3-2-4-6-9/h3,5,9H,2,4,6-8H2,1H3/b5-3-.
What are the key properties of (Z)-6-(methoxymethoxy)hex-4-en-1-ol?
(Z)-6-(methoxymethoxy)hex-4-en-1-ol has a molecular weight of 160.21 g/mol, XLogP of 0.94, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-6-(methoxymethoxy)hex-4-en-1-ol is sourced from PubChem (CID 10511158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).