10-(methoxymethoxy)decanoic acid

C12H24O4 — CID 19032994

IUPAC10-(methoxymethoxy)decanoic acid
SMILESCOCOCCCCCCCCCC(=O)O
InChIInChI=1S/C12H24O4/c1-15-11-16-10-8-6-4-2-3-5-7-9-12(13)14/h2-11H2,1H3,(H,13,14)
InChIKeyCHBQTKUKTGKBKL-UHFFFAOYSA-N
MW232.32 g/mol
LogP2.81
Rot. Bonds12

About 10-(methoxymethoxy)decanoic acid

10-(methoxymethoxy)decanoic acid (PubChem CID 19032994) has the molecular formula C12H24O4 and a molecular weight of 232.32 g/mol. Its IUPAC name is 10-(methoxymethoxy)decanoic acid.

Molecular Properties

Compound Name10-(methoxymethoxy)decanoic acid
PubChem CID19032994
Molecular FormulaC12H24O4
Molecular Weight232.32 g/mol
Exact Mass232.17
IUPAC Name10-(methoxymethoxy)decanoic acid
SMILESCOCOCCCCCCCCCC(=O)O
InChIInChI=1S/C12H24O4/c1-15-11-16-10-8-6-4-2-3-5-7-9-12(13)14/h2-11H2,1H3,(H,13,14)
InChIKeyCHBQTKUKTGKBKL-UHFFFAOYSA-N
XLogP2.81
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 10-(methoxymethoxy)decanoic acid?
The IUPAC name of 10-(methoxymethoxy)decanoic acid (CID 19032994) is 10-(methoxymethoxy)decanoic acid.
What is the SMILES notation for 10-(methoxymethoxy)decanoic acid?
The canonical SMILES for 10-(methoxymethoxy)decanoic acid is COCOCCCCCCCCCC(=O)O.
What is the InChIKey of 10-(methoxymethoxy)decanoic acid?
The InChIKey is CHBQTKUKTGKBKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O4/c1-15-11-16-10-8-6-4-2-3-5-7-9-12(13)14/h2-11H2,1H3,(H,13,14).
What are the key properties of 10-(methoxymethoxy)decanoic acid?
10-(methoxymethoxy)decanoic acid has a molecular weight of 232.32 g/mol, XLogP of 2.81, 12 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(methoxymethoxy)decanoic acid is sourced from PubChem (CID 19032994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).