[3-(methoxymethyl)cyclohexyl]methanol

C9H18O2 — CID 18710493

IUPAC[3-(methoxymethyl)cyclohexyl]methanol
SMILESCOCC1CCCC(CO)C1
InChIInChI=1S/C9H18O2/c1-11-7-9-4-2-3-8(5-9)6-10/h8-10H,2-7H2,1H3
InChIKeyASDCZBGHESAKDD-UHFFFAOYSA-N
MW158.24 g/mol
LogP1.43
Rot. Bonds3

About [3-(methoxymethyl)cyclohexyl]methanol

[3-(methoxymethyl)cyclohexyl]methanol (PubChem CID 18710493) has the molecular formula C9H18O2 and a molecular weight of 158.24 g/mol. Its IUPAC name is [3-(methoxymethyl)cyclohexyl]methanol.

Molecular Properties

Compound Name[3-(methoxymethyl)cyclohexyl]methanol
PubChem CID18710493
Molecular FormulaC9H18O2
Molecular Weight158.24 g/mol
Exact Mass158.13
IUPAC Name[3-(methoxymethyl)cyclohexyl]methanol
SMILESCOCC1CCCC(CO)C1
InChIInChI=1S/C9H18O2/c1-11-7-9-4-2-3-8(5-9)6-10/h8-10H,2-7H2,1H3
InChIKeyASDCZBGHESAKDD-UHFFFAOYSA-N
XLogP1.43
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-(methoxymethyl)cyclohexyl]methanol?
The IUPAC name of [3-(methoxymethyl)cyclohexyl]methanol (CID 18710493) is [3-(methoxymethyl)cyclohexyl]methanol.
What is the SMILES notation for [3-(methoxymethyl)cyclohexyl]methanol?
The canonical SMILES for [3-(methoxymethyl)cyclohexyl]methanol is COCC1CCCC(CO)C1.
What is the InChIKey of [3-(methoxymethyl)cyclohexyl]methanol?
The InChIKey is ASDCZBGHESAKDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O2/c1-11-7-9-4-2-3-8(5-9)6-10/h8-10H,2-7H2,1H3.
What are the key properties of [3-(methoxymethyl)cyclohexyl]methanol?
[3-(methoxymethyl)cyclohexyl]methanol has a molecular weight of 158.24 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(methoxymethyl)cyclohexyl]methanol is sourced from PubChem (CID 18710493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).