1-(ethenoxymethyl)-1-methylcyclohexane

C10H18O — CID 20824813

IUPAC1-(ethenoxymethyl)-1-methylcyclohexane
SMILESC=COCC1(C)CCCCC1
InChIInChI=1S/C10H18O/c1-3-11-9-10(2)7-5-4-6-8-10/h3H,1,4-9H2,2H3
InChIKeyZQKPCBQQPVYEAD-UHFFFAOYSA-N
MW154.25 g/mol
LogP3.12
Rot. Bonds3

About 1-(ethenoxymethyl)-1-methylcyclohexane

1-(ethenoxymethyl)-1-methylcyclohexane (PubChem CID 20824813) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 1-(ethenoxymethyl)-1-methylcyclohexane.

Molecular Properties

Compound Name1-(ethenoxymethyl)-1-methylcyclohexane
PubChem CID20824813
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name1-(ethenoxymethyl)-1-methylcyclohexane
SMILESC=COCC1(C)CCCCC1
InChIInChI=1S/C10H18O/c1-3-11-9-10(2)7-5-4-6-8-10/h3H,1,4-9H2,2H3
InChIKeyZQKPCBQQPVYEAD-UHFFFAOYSA-N
XLogP3.12
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(ethenoxymethyl)-1-methylcyclohexane?
The IUPAC name of 1-(ethenoxymethyl)-1-methylcyclohexane (CID 20824813) is 1-(ethenoxymethyl)-1-methylcyclohexane.
What is the SMILES notation for 1-(ethenoxymethyl)-1-methylcyclohexane?
The canonical SMILES for 1-(ethenoxymethyl)-1-methylcyclohexane is C=COCC1(C)CCCCC1.
What is the InChIKey of 1-(ethenoxymethyl)-1-methylcyclohexane?
The InChIKey is ZQKPCBQQPVYEAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-3-11-9-10(2)7-5-4-6-8-10/h3H,1,4-9H2,2H3.
What are the key properties of 1-(ethenoxymethyl)-1-methylcyclohexane?
1-(ethenoxymethyl)-1-methylcyclohexane has a molecular weight of 154.25 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethenoxymethyl)-1-methylcyclohexane is sourced from PubChem (CID 20824813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).