4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol

C10H20O4 — CID 102050979

IUPAC4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol
SMILESC=C(CC(C)(C)O)OCOCCOC
InChIInChI=1S/C10H20O4/c1-9(7-10(2,3)11)14-8-13-6-5-12-4/h11H,1,5-8H2,2-4H3
InChIKeyWSFBBQXLPHRQQH-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.30
Rot. Bonds8

About 4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol

4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol (PubChem CID 102050979) has the molecular formula C10H20O4 and a molecular weight of 204.27 g/mol. Its IUPAC name is 4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol.

Molecular Properties

Compound Name4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol
PubChem CID102050979
Molecular FormulaC10H20O4
Molecular Weight204.27 g/mol
Exact Mass204.14
IUPAC Name4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol
SMILESC=C(CC(C)(C)O)OCOCCOC
InChIInChI=1S/C10H20O4/c1-9(7-10(2,3)11)14-8-13-6-5-12-4/h11H,1,5-8H2,2-4H3
InChIKeyWSFBBQXLPHRQQH-UHFFFAOYSA-N
XLogP1.30
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(Methoxymethoxy)-2,3-dimethyl-1,4,5-hexatrien-3-ol
CID 24973592

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol?
The IUPAC name of 4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol (CID 102050979) is 4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol.
What is the SMILES notation for 4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol?
The canonical SMILES for 4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol is C=C(CC(C)(C)O)OCOCCOC.
What is the InChIKey of 4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol?
The InChIKey is WSFBBQXLPHRQQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O4/c1-9(7-10(2,3)11)14-8-13-6-5-12-4/h11H,1,5-8H2,2-4H3.
What are the key properties of 4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol?
4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol has a molecular weight of 204.27 g/mol, XLogP of 1.30, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethoxymethoxy)-2-methylpent-4-en-2-ol is sourced from PubChem (CID 102050979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).