[4-(ethoxymethyl)cyclohexyl]methanol

C10H20O2 — CID 67066913

IUPAC[4-(ethoxymethyl)cyclohexyl]methanol
SMILESCCOCC1CCC(CO)CC1
InChIInChI=1S/C10H20O2/c1-2-12-8-10-5-3-9(7-11)4-6-10/h9-11H,2-8H2,1H3
InChIKeyOAVRCEMIXVEDFR-UHFFFAOYSA-N
MW172.27 g/mol
LogP1.82
Rot. Bonds4

About [4-(ethoxymethyl)cyclohexyl]methanol

[4-(ethoxymethyl)cyclohexyl]methanol (PubChem CID 67066913) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is [4-(ethoxymethyl)cyclohexyl]methanol.

Molecular Properties

Compound Name[4-(ethoxymethyl)cyclohexyl]methanol
PubChem CID67066913
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name[4-(ethoxymethyl)cyclohexyl]methanol
SMILESCCOCC1CCC(CO)CC1
InChIInChI=1S/C10H20O2/c1-2-12-8-10-5-3-9(7-11)4-6-10/h9-11H,2-8H2,1H3
InChIKeyOAVRCEMIXVEDFR-UHFFFAOYSA-N
XLogP1.82
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(ethoxymethyl)cyclohexyl]methanol?
The IUPAC name of [4-(ethoxymethyl)cyclohexyl]methanol (CID 67066913) is [4-(ethoxymethyl)cyclohexyl]methanol.
What is the SMILES notation for [4-(ethoxymethyl)cyclohexyl]methanol?
The canonical SMILES for [4-(ethoxymethyl)cyclohexyl]methanol is CCOCC1CCC(CO)CC1.
What is the InChIKey of [4-(ethoxymethyl)cyclohexyl]methanol?
The InChIKey is OAVRCEMIXVEDFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-2-12-8-10-5-3-9(7-11)4-6-10/h9-11H,2-8H2,1H3.
What are the key properties of [4-(ethoxymethyl)cyclohexyl]methanol?
[4-(ethoxymethyl)cyclohexyl]methanol has a molecular weight of 172.27 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethoxymethyl)cyclohexyl]methanol is sourced from PubChem (CID 67066913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).