1-(methoxymethoxy)octane

C10H22O2 — CID 10931936

IUPAC1-(methoxymethoxy)octane
SMILESCCCCCCCCOCOC
InChIInChI=1S/C10H22O2/c1-3-4-5-6-7-8-9-12-10-11-2/h3-10H2,1-2H3
InChIKeyYVWYUOPDUSDKMG-UHFFFAOYSA-N
MW174.28 g/mol
LogP2.97
Rot. Bonds9

About 1-(methoxymethoxy)octane

1-(methoxymethoxy)octane (PubChem CID 10931936) has the molecular formula C10H22O2 and a molecular weight of 174.28 g/mol. Its IUPAC name is 1-(methoxymethoxy)octane.

Molecular Properties

Compound Name1-(methoxymethoxy)octane
PubChem CID10931936
Molecular FormulaC10H22O2
Molecular Weight174.28 g/mol
Exact Mass174.16
IUPAC Name1-(methoxymethoxy)octane
SMILESCCCCCCCCOCOC
InChIInChI=1S/C10H22O2/c1-3-4-5-6-7-8-9-12-10-11-2/h3-10H2,1-2H3
InChIKeyYVWYUOPDUSDKMG-UHFFFAOYSA-N
XLogP2.97
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.28
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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

1,1-Dimethoxyoctane
CID 61431
Decanal dimethyl acetal
CID 24513
1,1-Dimethoxyheptane
CID 61453
Nonane, 1,1-diethoxy-
CID 108625
Dicaprylyl Carbonate
CID 9904000
Heptane, 1,1-diethoxy-
CID 69644
1,1-Diethoxyoctane
CID 101364
Formaldehyde cyclododecyl ethyl acetal
CID 94111
1,1-Dimethoxydodecane
CID 84559
Nonanal dimethyl acetal
CID 87813
1,1-Diethoxydecane
CID 101363
Undecane, 1,1-diethoxy-
CID 104486

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethoxy)octane?
The IUPAC name of 1-(methoxymethoxy)octane (CID 10931936) is 1-(methoxymethoxy)octane.
What is the SMILES notation for 1-(methoxymethoxy)octane?
The canonical SMILES for 1-(methoxymethoxy)octane is CCCCCCCCOCOC.
What is the InChIKey of 1-(methoxymethoxy)octane?
The InChIKey is YVWYUOPDUSDKMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O2/c1-3-4-5-6-7-8-9-12-10-11-2/h3-10H2,1-2H3.
What are the key properties of 1-(methoxymethoxy)octane?
1-(methoxymethoxy)octane has a molecular weight of 174.28 g/mol, XLogP of 2.97, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethoxy)octane is sourced from PubChem (CID 10931936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).