2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane

C12H24O2 — CID 11506656

IUPAC2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane
SMILESCOCOC1CC(C)CCC1C(C)C
InChIInChI=1S/C12H24O2/c1-9(2)11-6-5-10(3)7-12(11)14-8-13-4/h9-12H,5-8H2,1-4H3
InChIKeyIMFNXDRFEFZAIK-UHFFFAOYSA-N
MW200.32 g/mol
LogP3.07
Rot. Bonds4

About 2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane

2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane (PubChem CID 11506656) has the molecular formula C12H24O2 and a molecular weight of 200.32 g/mol. Its IUPAC name is 2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane.

Molecular Properties

Compound Name2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane
PubChem CID11506656
Molecular FormulaC12H24O2
Molecular Weight200.32 g/mol
Exact Mass200.18
IUPAC Name2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane
SMILESCOCOC1CC(C)CCC1C(C)C
InChIInChI=1S/C12H24O2/c1-9(2)11-6-5-10(3)7-12(11)14-8-13-4/h9-12H,5-8H2,1-4H3
InChIKeyIMFNXDRFEFZAIK-UHFFFAOYSA-N
XLogP3.07
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 53.07
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 2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane?
The IUPAC name of 2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane (CID 11506656) is 2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane.
What is the SMILES notation for 2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane?
The canonical SMILES for 2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane is COCOC1CC(C)CCC1C(C)C.
What is the InChIKey of 2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane?
The InChIKey is IMFNXDRFEFZAIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2/c1-9(2)11-6-5-10(3)7-12(11)14-8-13-4/h9-12H,5-8H2,1-4H3.
What are the key properties of 2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane?
2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane has a molecular weight of 200.32 g/mol, XLogP of 3.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethoxy)-4-methyl-1-propan-2-ylcyclohexane is sourced from PubChem (CID 11506656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).