hydrogen peroxide;methane;molecular oxygen

C4H20O8 — CID 159665165

IUPAChydrogen peroxide;methane;molecular oxygen
SMILESC.C.C.C.O=O.O=O.OO.OO
InChIInChI=1S/4CH4.2H2O2.2O2/c;;;;4*1-2/h4*1H4;2*1-2H;;
InChIKeyMTHUSXLPMVSWSL-UHFFFAOYSA-N
MW196.20 g/mol
LogP2.71
Rot. Bonds

About hydrogen peroxide;methane;molecular oxygen

hydrogen peroxide;methane;molecular oxygen (PubChem CID 159665165) has the molecular formula C4H20O8 and a molecular weight of 196.20 g/mol. Its IUPAC name is hydrogen peroxide;methane;molecular oxygen.

Molecular Properties

Compound Namehydrogen peroxide;methane;molecular oxygen
PubChem CID159665165
Molecular FormulaC4H20O8
Molecular Weight196.20 g/mol
Exact Mass196.12
IUPAC Namehydrogen peroxide;methane;molecular oxygen
SMILESC.C.C.C.O=O.O=O.OO.OO
InChIInChI=1S/4CH4.2H2O2.2O2/c;;;;4*1-2/h4*1H4;2*1-2H;;
InChIKeyMTHUSXLPMVSWSL-UHFFFAOYSA-N
XLogP2.71
TPSA149.20 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.20
LogP ≤ 52.71
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze hydrogen peroxide;methane;molecular oxygen 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

hydrogen peroxide;methane;molecular oxygen
CID 161121737
hydrogen peroxide;methane;molecular oxygen;hydrate
CID 169431081
hydrogen peroxide;methane;molecular oxygen;platinum;hydrate
CID 158564588
deuterium monohydride;hydrogen peroxide;molecular oxygen
CID 158019511
CID 161469049
CID 161469049
methane;molecular oxygen;dihydrate
CID 169423801
dicalcium;carbonic acid;hydride;methane
CID 173330870
hydrogen peroxide
CID 21255768
hydrogen peroxide
CID 159255937
hydrogen peroxide;oxonickel
CID 174479831
potassium;hydrogen peroxide;permanganate
CID 23710207
sodium;carbonic acid;hydride;iron;methane
CID 174461650

Frequently Asked Questions

What is the IUPAC name of hydrogen peroxide;methane;molecular oxygen?
The IUPAC name of hydrogen peroxide;methane;molecular oxygen (CID 159665165) is hydrogen peroxide;methane;molecular oxygen.
What is the SMILES notation for hydrogen peroxide;methane;molecular oxygen?
The canonical SMILES for hydrogen peroxide;methane;molecular oxygen is C.C.C.C.O=O.O=O.OO.OO.
What is the InChIKey of hydrogen peroxide;methane;molecular oxygen?
The InChIKey is MTHUSXLPMVSWSL-UHFFFAOYSA-N. The full InChI is InChI=1S/4CH4.2H2O2.2O2/c;;;;4*1-2/h4*1H4;2*1-2H;;.
What are the key properties of hydrogen peroxide;methane;molecular oxygen?
hydrogen peroxide;methane;molecular oxygen has a molecular weight of 196.20 g/mol, XLogP of 2.71, 0 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for hydrogen peroxide;methane;molecular oxygen is sourced from PubChem (CID 159665165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).