methoxyperoxyperoxyperoxyethane

C3H8O7 — CID 89243082

IUPACmethoxyperoxyperoxyperoxyethane
SMILESCCOOOOOOOC
InChIInChI=1S/C3H8O7/c1-3-5-7-9-10-8-6-4-2/h3H2,1-2H3
InChIKeyQDLGKHGWTDMKTI-UHFFFAOYSA-N
MW156.09 g/mol
LogP0.24
Rot. Bonds7

About methoxyperoxyperoxyperoxyethane

methoxyperoxyperoxyperoxyethane (PubChem CID 89243082) has the molecular formula C3H8O7 and a molecular weight of 156.09 g/mol. Its IUPAC name is methoxyperoxyperoxyperoxyethane.

Molecular Properties

Compound Namemethoxyperoxyperoxyperoxyethane
PubChem CID89243082
Molecular FormulaC3H8O7
Molecular Weight156.09 g/mol
Exact Mass156.03
IUPAC Namemethoxyperoxyperoxyperoxyethane
SMILESCCOOOOOOOC
InChIInChI=1S/C3H8O7/c1-3-5-7-9-10-8-6-4-2/h3H2,1-2H3
InChIKeyQDLGKHGWTDMKTI-UHFFFAOYSA-N
XLogP0.24
TPSA64.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.09
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Analyze methoxyperoxyperoxyperoxyethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

hydroperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyperoxyethane
CID 89194899
ethoxyperoxyethane;phosphane
CID 174988204
methylperoxyethane;niobium
CID 139791519
dipotassium;hydride;methylperoxyperoxyperoxyperoxymethane
CID 173149052
CID 173381512
CID 173381512
azane;ethoxyperoxyethane;sulfuric acid
CID 175377897
ethoxyperoxyethane;propane-1,2-diol
CID 87183178
1-ethoxyperoxyethane-1,1-diol
CID 87123347
CID 162198765
CID 162198765
sulfanylperoxyperoxymethane
CID 23404984
methane;methoxyethane
CID 158573885
methoxyethane;hydroiodide
CID 162009435

Frequently Asked Questions

What is the IUPAC name of methoxyperoxyperoxyperoxyethane?
The IUPAC name of methoxyperoxyperoxyperoxyethane (CID 89243082) is methoxyperoxyperoxyperoxyethane.
What is the SMILES notation for methoxyperoxyperoxyperoxyethane?
The canonical SMILES for methoxyperoxyperoxyperoxyethane is CCOOOOOOOC.
What is the InChIKey of methoxyperoxyperoxyperoxyethane?
The InChIKey is QDLGKHGWTDMKTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O7/c1-3-5-7-9-10-8-6-4-2/h3H2,1-2H3.
What are the key properties of methoxyperoxyperoxyperoxyethane?
methoxyperoxyperoxyperoxyethane has a molecular weight of 156.09 g/mol, XLogP of 0.24, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methoxyperoxyperoxyperoxyethane is sourced from PubChem (CID 89243082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).