2-(cyclohexylidenemethoxymethyl)-2-methyloxirane

C11H18O2 — CID 176604430

IUPAC2-(cyclohexylidenemethoxymethyl)-2-methyloxirane
SMILESCC1(COC=C2CCCCC2)CO1
InChIInChI=1S/C11H18O2/c1-11(9-13-11)8-12-7-10-5-3-2-4-6-10/h7H,2-6,8-9H2,1H3
InChIKeyZTGZGDZRVWLVMY-UHFFFAOYSA-N
MW182.26 g/mol
LogP2.64
Rot. Bonds3

About 2-(cyclohexylidenemethoxymethyl)-2-methyloxirane

2-(cyclohexylidenemethoxymethyl)-2-methyloxirane (PubChem CID 176604430) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol. Its IUPAC name is 2-(cyclohexylidenemethoxymethyl)-2-methyloxirane.

Molecular Properties

Compound Name2-(cyclohexylidenemethoxymethyl)-2-methyloxirane
PubChem CID176604430
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name2-(cyclohexylidenemethoxymethyl)-2-methyloxirane
SMILESCC1(COC=C2CCCCC2)CO1
InChIInChI=1S/C11H18O2/c1-11(9-13-11)8-12-7-10-5-3-2-4-6-10/h7H,2-6,8-9H2,1H3
InChIKeyZTGZGDZRVWLVMY-UHFFFAOYSA-N
XLogP2.64
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.26
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[[(E)-2-ethylhex-1-enoxy]methyl]oxirane
CID 88851730
2-(2-Ethylhex-1-enoxymethyl)oxirane
CID 123491616
1-[2-(2-Ethoxyethoxy)ethoxymethylidene]-4-methylidenecyclohexane
CID 156647449
2-(2-Ethoxyethoxy)ethoxymethylidenecyclohexane
CID 175229512
2-(Cyclopentylidenemethoxymethyl)-2-methyloxirane
CID 176603955
2-[2-(Cyclohexylidenemethoxy)ethyl]-2-methyloxirane
CID 176604518
2-(Cyclohexylidenemethoxymethyl)-2-ethyloxirane
CID 176604663
2-[1-(Cyclohexylidenemethoxy)ethyl]oxirane
CID 176604726
2-(Cyclohexylidenemethoxymethyl)-2-methyl-1,4-dioxane
CID 176605260
2-(Cyclohexylidenemethoxymethyl)oxirane
CID 176605328

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylidenemethoxymethyl)-2-methyloxirane?
The IUPAC name of 2-(cyclohexylidenemethoxymethyl)-2-methyloxirane (CID 176604430) is 2-(cyclohexylidenemethoxymethyl)-2-methyloxirane.
What is the SMILES notation for 2-(cyclohexylidenemethoxymethyl)-2-methyloxirane?
The canonical SMILES for 2-(cyclohexylidenemethoxymethyl)-2-methyloxirane is CC1(COC=C2CCCCC2)CO1.
What is the InChIKey of 2-(cyclohexylidenemethoxymethyl)-2-methyloxirane?
The InChIKey is ZTGZGDZRVWLVMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O2/c1-11(9-13-11)8-12-7-10-5-3-2-4-6-10/h7H,2-6,8-9H2,1H3.
What are the key properties of 2-(cyclohexylidenemethoxymethyl)-2-methyloxirane?
2-(cyclohexylidenemethoxymethyl)-2-methyloxirane has a molecular weight of 182.26 g/mol, XLogP of 2.64, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylidenemethoxymethyl)-2-methyloxirane is sourced from PubChem (CID 176604430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).