methoxymethylcyclohexane

C8H16O — CID 6432218

IUPACmethoxymethylcyclohexane
SMILESCOCC1CCCCC1
InChIInChI=1S/C8H16O/c1-9-7-8-5-3-2-4-6-8/h8H,2-7H2,1H3
InChIKeyUXXIFJBQPUDTNK-UHFFFAOYSA-N
MW128.22 g/mol
LogP2.21
Rot. Bonds2

About methoxymethylcyclohexane

methoxymethylcyclohexane (PubChem CID 6432218) has the molecular formula C8H16O and a molecular weight of 128.22 g/mol. Its IUPAC name is methoxymethylcyclohexane.

Molecular Properties

Compound Namemethoxymethylcyclohexane
PubChem CID6432218
Molecular FormulaC8H16O
Molecular Weight128.22 g/mol
Exact Mass128.12
IUPAC Namemethoxymethylcyclohexane
SMILESCOCC1CCCCC1
InChIInChI=1S/C8H16O/c1-9-7-8-5-3-2-4-6-8/h8H,2-7H2,1H3
InChIKeyUXXIFJBQPUDTNK-UHFFFAOYSA-N
XLogP2.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of methoxymethylcyclohexane?
The IUPAC name of methoxymethylcyclohexane (CID 6432218) is methoxymethylcyclohexane.
What is the SMILES notation for methoxymethylcyclohexane?
The canonical SMILES for methoxymethylcyclohexane is COCC1CCCCC1.
What is the InChIKey of methoxymethylcyclohexane?
The InChIKey is UXXIFJBQPUDTNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O/c1-9-7-8-5-3-2-4-6-8/h8H,2-7H2,1H3.
What are the key properties of methoxymethylcyclohexane?
methoxymethylcyclohexane has a molecular weight of 128.22 g/mol, XLogP of 2.21, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethylcyclohexane is sourced from PubChem (CID 6432218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).