1-(methoxymethoxymethyl)-1-methylcyclohexane

C10H20O2 — CID 59922638

IUPAC1-(methoxymethoxymethyl)-1-methylcyclohexane
SMILESCOCOCC1(C)CCCCC1
InChIInChI=1S/C10H20O2/c1-10(8-12-9-11-2)6-4-3-5-7-10/h3-9H2,1-2H3
InChIKeyPRCQWWZMPDXHDI-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.58
Rot. Bonds4

About 1-(methoxymethoxymethyl)-1-methylcyclohexane

1-(methoxymethoxymethyl)-1-methylcyclohexane (PubChem CID 59922638) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 1-(methoxymethoxymethyl)-1-methylcyclohexane.

Molecular Properties

Compound Name1-(methoxymethoxymethyl)-1-methylcyclohexane
PubChem CID59922638
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name1-(methoxymethoxymethyl)-1-methylcyclohexane
SMILESCOCOCC1(C)CCCCC1
InChIInChI=1S/C10H20O2/c1-10(8-12-9-11-2)6-4-3-5-7-10/h3-9H2,1-2H3
InChIKeyPRCQWWZMPDXHDI-UHFFFAOYSA-N
XLogP2.58
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.58
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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Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethoxymethyl)-1-methylcyclohexane?
The IUPAC name of 1-(methoxymethoxymethyl)-1-methylcyclohexane (CID 59922638) is 1-(methoxymethoxymethyl)-1-methylcyclohexane.
What is the SMILES notation for 1-(methoxymethoxymethyl)-1-methylcyclohexane?
The canonical SMILES for 1-(methoxymethoxymethyl)-1-methylcyclohexane is COCOCC1(C)CCCCC1.
What is the InChIKey of 1-(methoxymethoxymethyl)-1-methylcyclohexane?
The InChIKey is PRCQWWZMPDXHDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-10(8-12-9-11-2)6-4-3-5-7-10/h3-9H2,1-2H3.
What are the key properties of 1-(methoxymethoxymethyl)-1-methylcyclohexane?
1-(methoxymethoxymethyl)-1-methylcyclohexane has a molecular weight of 172.27 g/mol, XLogP of 2.58, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethoxymethyl)-1-methylcyclohexane is sourced from PubChem (CID 59922638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).