ethoxymethoxymethanol

C4H10O3 — CID 19047955

IUPACethoxymethoxymethanol
SMILESCCOCOCO
InChIInChI=1S/C4H10O3/c1-2-6-4-7-3-5/h5H,2-4H2,1H3
InChIKeySALCVIXXSCLRQC-UHFFFAOYSA-N
MW106.12 g/mol
LogP-0.05
Rot. Bonds4

About ethoxymethoxymethanol

ethoxymethoxymethanol (PubChem CID 19047955) has the molecular formula C4H10O3 and a molecular weight of 106.12 g/mol. Its IUPAC name is ethoxymethoxymethanol.

Molecular Properties

Compound Nameethoxymethoxymethanol
PubChem CID19047955
Molecular FormulaC4H10O3
Molecular Weight106.12 g/mol
Exact Mass106.06
IUPAC Nameethoxymethoxymethanol
SMILESCCOCOCO
InChIInChI=1S/C4H10O3/c1-2-6-4-7-3-5/h5H,2-4H2,1H3
InChIKeySALCVIXXSCLRQC-UHFFFAOYSA-N
XLogP-0.05
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.12
LogP ≤ 5-0.05
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 ethoxymethoxymethanol?
The IUPAC name of ethoxymethoxymethanol (CID 19047955) is ethoxymethoxymethanol.
What is the SMILES notation for ethoxymethoxymethanol?
The canonical SMILES for ethoxymethoxymethanol is CCOCOCO.
What is the InChIKey of ethoxymethoxymethanol?
The InChIKey is SALCVIXXSCLRQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O3/c1-2-6-4-7-3-5/h5H,2-4H2,1H3.
What are the key properties of ethoxymethoxymethanol?
ethoxymethoxymethanol has a molecular weight of 106.12 g/mol, XLogP of -0.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxymethoxymethanol is sourced from PubChem (CID 19047955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).