methoxymethoxycyclohexane

C8H16O2 — CID 11018995

IUPACmethoxymethoxycyclohexane
SMILESCOCOC1CCCCC1
InChIInChI=1S/C8H16O2/c1-9-7-10-8-5-3-2-4-6-8/h8H,2-7H2,1H3
InChIKeyQLPPJSYDXNHJMH-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.94
Rot. Bonds3

About methoxymethoxycyclohexane

methoxymethoxycyclohexane (PubChem CID 11018995) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is methoxymethoxycyclohexane.

Molecular Properties

Compound Namemethoxymethoxycyclohexane
PubChem CID11018995
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Namemethoxymethoxycyclohexane
SMILESCOCOC1CCCCC1
InChIInChI=1S/C8H16O2/c1-9-7-10-8-5-3-2-4-6-8/h8H,2-7H2,1H3
InChIKeyQLPPJSYDXNHJMH-UHFFFAOYSA-N
XLogP1.94
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methoxymethoxycyclohexane?
The IUPAC name of methoxymethoxycyclohexane (CID 11018995) is methoxymethoxycyclohexane.
What is the SMILES notation for methoxymethoxycyclohexane?
The canonical SMILES for methoxymethoxycyclohexane is COCOC1CCCCC1.
What is the InChIKey of methoxymethoxycyclohexane?
The InChIKey is QLPPJSYDXNHJMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-9-7-10-8-5-3-2-4-6-8/h8H,2-7H2,1H3.
What are the key properties of methoxymethoxycyclohexane?
methoxymethoxycyclohexane has a molecular weight of 144.21 g/mol, XLogP of 1.94, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethoxycyclohexane is sourced from PubChem (CID 11018995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).