(2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde

C10H18O3 — CID 11332891

IUPAC(2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde
SMILESCOCO[C@@H](C=O)C1CCCCC1
InChIInChI=1S/C10H18O3/c1-12-8-13-10(7-11)9-5-3-2-4-6-9/h7,9-10H,2-6,8H2,1H3/t10-/m0/s1
InChIKeyKEFHUIMQXZXMLZ-JTQLQIEISA-N
MW186.25 g/mol
LogP1.75
Rot. Bonds5

About (2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde

(2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde (PubChem CID 11332891) has the molecular formula C10H18O3 and a molecular weight of 186.25 g/mol. Its IUPAC name is (2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde.

Molecular Properties

Compound Name(2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde
PubChem CID11332891
Molecular FormulaC10H18O3
Molecular Weight186.25 g/mol
Exact Mass186.13
IUPAC Name(2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde
SMILESCOCO[C@@H](C=O)C1CCCCC1
InChIInChI=1S/C10H18O3/c1-12-8-13-10(7-11)9-5-3-2-4-6-9/h7,9-10H,2-6,8H2,1H3/t10-/m0/s1
InChIKeyKEFHUIMQXZXMLZ-JTQLQIEISA-N
XLogP1.75
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde?
The IUPAC name of (2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde (CID 11332891) is (2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde.
What is the SMILES notation for (2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde?
The canonical SMILES for (2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde is COCO[C@@H](C=O)C1CCCCC1.
What is the InChIKey of (2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde?
The InChIKey is KEFHUIMQXZXMLZ-JTQLQIEISA-N. The full InChI is InChI=1S/C10H18O3/c1-12-8-13-10(7-11)9-5-3-2-4-6-9/h7,9-10H,2-6,8H2,1H3/t10-/m0/s1.
What are the key properties of (2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde?
(2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde has a molecular weight of 186.25 g/mol, XLogP of 1.75, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-cyclohexyl-2-(methoxymethoxy)acetaldehyde is sourced from PubChem (CID 11332891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).