2-(cyclohexylidenemethoxymethyl)oxirane

C10H16O2 — CID 176605328

IUPAC2-(cyclohexylidenemethoxymethyl)oxirane
SMILESC(OCC1CO1)=C1CCCCC1
InChIInChI=1S/C10H16O2/c1-2-4-9(5-3-1)6-11-7-10-8-12-10/h6,10H,1-5,7-8H2
InChIKeySAWXNQWSLJCIND-UHFFFAOYSA-N
MW168.24 g/mol
LogP2.25
Rot. Bonds3

About 2-(cyclohexylidenemethoxymethyl)oxirane

2-(cyclohexylidenemethoxymethyl)oxirane (PubChem CID 176605328) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is 2-(cyclohexylidenemethoxymethyl)oxirane.

Molecular Properties

Compound Name2-(cyclohexylidenemethoxymethyl)oxirane
PubChem CID176605328
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name2-(cyclohexylidenemethoxymethyl)oxirane
SMILESC(OCC1CO1)=C1CCCCC1
InChIInChI=1S/C10H16O2/c1-2-4-9(5-3-1)6-11-7-10-8-12-10/h6,10H,1-5,7-8H2
InChIKeySAWXNQWSLJCIND-UHFFFAOYSA-N
XLogP2.25
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.25
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
2-(Cyclohexylidenemethoxymethyl)-1,4-dioxane
CID 176602915
3-(Cyclohexylidenemethoxy)oxolane
CID 176603024
2-[2-(Cyclohexylidenemethoxy)ethyl]oxirane
CID 176603494
2-(Cyclopentylidenemethoxymethyl)oxirane
CID 176603641
2-(Cyclohexylidenemethoxymethyl)-2-methyloxirane
CID 176604430
2-(Cyclohexylidenemethoxymethyl)-2-ethyloxirane
CID 176604663
2-[1-(Cyclohexylidenemethoxy)ethyl]oxirane
CID 176604726

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylidenemethoxymethyl)oxirane?
The IUPAC name of 2-(cyclohexylidenemethoxymethyl)oxirane (CID 176605328) is 2-(cyclohexylidenemethoxymethyl)oxirane.
What is the SMILES notation for 2-(cyclohexylidenemethoxymethyl)oxirane?
The canonical SMILES for 2-(cyclohexylidenemethoxymethyl)oxirane is C(OCC1CO1)=C1CCCCC1.
What is the InChIKey of 2-(cyclohexylidenemethoxymethyl)oxirane?
The InChIKey is SAWXNQWSLJCIND-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-2-4-9(5-3-1)6-11-7-10-8-12-10/h6,10H,1-5,7-8H2.
What are the key properties of 2-(cyclohexylidenemethoxymethyl)oxirane?
2-(cyclohexylidenemethoxymethyl)oxirane has a molecular weight of 168.24 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylidenemethoxymethyl)oxirane is sourced from PubChem (CID 176605328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).