1-[ethoxy(methoxy)methoxy]naphthalene

C14H16O3 — CID 173038488

IUPAC1-[ethoxy(methoxy)methoxy]naphthalene
SMILESCCOC(OC)Oc1cccc2ccccc12
InChIInChI=1S/C14H16O3/c1-3-16-14(15-2)17-13-10-6-8-11-7-4-5-9-12(11)13/h4-10,14H,3H2,1-2H3
InChIKeyQPKHPVQWUXYIIR-UHFFFAOYSA-N
MW232.28 g/mol
LogP3.19
Rot. Bonds5

About 1-[ethoxy(methoxy)methoxy]naphthalene

1-[ethoxy(methoxy)methoxy]naphthalene (PubChem CID 173038488) has the molecular formula C14H16O3 and a molecular weight of 232.28 g/mol. Its IUPAC name is 1-[ethoxy(methoxy)methoxy]naphthalene.

Molecular Properties

Compound Name1-[ethoxy(methoxy)methoxy]naphthalene
PubChem CID173038488
Molecular FormulaC14H16O3
Molecular Weight232.28 g/mol
Exact Mass232.11
IUPAC Name1-[ethoxy(methoxy)methoxy]naphthalene
SMILESCCOC(OC)Oc1cccc2ccccc12
InChIInChI=1S/C14H16O3/c1-3-16-14(15-2)17-13-10-6-8-11-7-4-5-9-12(11)13/h4-10,14H,3H2,1-2H3
InChIKeyQPKHPVQWUXYIIR-UHFFFAOYSA-N
XLogP3.19
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[ethoxy(methoxy)methoxy]naphthalene?
The IUPAC name of 1-[ethoxy(methoxy)methoxy]naphthalene (CID 173038488) is 1-[ethoxy(methoxy)methoxy]naphthalene.
What is the SMILES notation for 1-[ethoxy(methoxy)methoxy]naphthalene?
The canonical SMILES for 1-[ethoxy(methoxy)methoxy]naphthalene is CCOC(OC)Oc1cccc2ccccc12.
What is the InChIKey of 1-[ethoxy(methoxy)methoxy]naphthalene?
The InChIKey is QPKHPVQWUXYIIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O3/c1-3-16-14(15-2)17-13-10-6-8-11-7-4-5-9-12(11)13/h4-10,14H,3H2,1-2H3.
What are the key properties of 1-[ethoxy(methoxy)methoxy]naphthalene?
1-[ethoxy(methoxy)methoxy]naphthalene has a molecular weight of 232.28 g/mol, XLogP of 3.19, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethoxy(methoxy)methoxy]naphthalene is sourced from PubChem (CID 173038488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).