1-(methoxymethyl)-1-propan-2-ylcyclohexane

C11H22O — CID 70370924

IUPAC1-(methoxymethyl)-1-propan-2-ylcyclohexane
SMILESCOCC1(C(C)C)CCCCC1
InChIInChI=1S/C11H22O/c1-10(2)11(9-12-3)7-5-4-6-8-11/h10H,4-9H2,1-3H3
InChIKeyZQDYPNFVKCFQGG-UHFFFAOYSA-N
MW170.30 g/mol
LogP3.24
Rot. Bonds3

About 1-(methoxymethyl)-1-propan-2-ylcyclohexane

1-(methoxymethyl)-1-propan-2-ylcyclohexane (PubChem CID 70370924) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is 1-(methoxymethyl)-1-propan-2-ylcyclohexane.

Molecular Properties

Compound Name1-(methoxymethyl)-1-propan-2-ylcyclohexane
PubChem CID70370924
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Name1-(methoxymethyl)-1-propan-2-ylcyclohexane
SMILESCOCC1(C(C)C)CCCCC1
InChIInChI=1S/C11H22O/c1-10(2)11(9-12-3)7-5-4-6-8-11/h10H,4-9H2,1-3H3
InChIKeyZQDYPNFVKCFQGG-UHFFFAOYSA-N
XLogP3.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-1-propan-2-ylcyclohexane?
The IUPAC name of 1-(methoxymethyl)-1-propan-2-ylcyclohexane (CID 70370924) is 1-(methoxymethyl)-1-propan-2-ylcyclohexane.
What is the SMILES notation for 1-(methoxymethyl)-1-propan-2-ylcyclohexane?
The canonical SMILES for 1-(methoxymethyl)-1-propan-2-ylcyclohexane is COCC1(C(C)C)CCCCC1.
What is the InChIKey of 1-(methoxymethyl)-1-propan-2-ylcyclohexane?
The InChIKey is ZQDYPNFVKCFQGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O/c1-10(2)11(9-12-3)7-5-4-6-8-11/h10H,4-9H2,1-3H3.
What are the key properties of 1-(methoxymethyl)-1-propan-2-ylcyclohexane?
1-(methoxymethyl)-1-propan-2-ylcyclohexane has a molecular weight of 170.30 g/mol, XLogP of 3.24, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-1-propan-2-ylcyclohexane is sourced from PubChem (CID 70370924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).