hydrogen peroxide;methane;molecular oxygen;hydrate

C8H38O7 — CID 169431081

IUPAChydrogen peroxide;methane;molecular oxygen;hydrate
SMILESC.C.C.C.C.C.C.C.O.O=O.OO.OO
InChIInChI=1S/8CH4.2H2O2.O2.H2O/c;;;;;;;;3*1-2;/h8*1H4;2*1-2H;;1H2
InChIKeySLZNGUANRBENFP-UHFFFAOYSA-N
MW246.39 g/mol
LogP4.37
Rot. Bonds

About hydrogen peroxide;methane;molecular oxygen;hydrate

hydrogen peroxide;methane;molecular oxygen;hydrate (PubChem CID 169431081) has the molecular formula C8H38O7 and a molecular weight of 246.39 g/mol. Its IUPAC name is hydrogen peroxide;methane;molecular oxygen;hydrate.

Molecular Properties

Compound Namehydrogen peroxide;methane;molecular oxygen;hydrate
PubChem CID169431081
Molecular FormulaC8H38O7
Molecular Weight246.39 g/mol
Exact Mass246.26
IUPAC Namehydrogen peroxide;methane;molecular oxygen;hydrate
SMILESC.C.C.C.C.C.C.C.O.O=O.OO.OO
InChIInChI=1S/8CH4.2H2O2.O2.H2O/c;;;;;;;;3*1-2;/h8*1H4;2*1-2H;;1H2
InChIKeySLZNGUANRBENFP-UHFFFAOYSA-N
XLogP4.37
TPSA146.56 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 54.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hydrogen peroxide;methane;molecular oxygen;hydrate?
The IUPAC name of hydrogen peroxide;methane;molecular oxygen;hydrate (CID 169431081) is hydrogen peroxide;methane;molecular oxygen;hydrate.
What is the SMILES notation for hydrogen peroxide;methane;molecular oxygen;hydrate?
The canonical SMILES for hydrogen peroxide;methane;molecular oxygen;hydrate is C.C.C.C.C.C.C.C.O.O=O.OO.OO.
What is the InChIKey of hydrogen peroxide;methane;molecular oxygen;hydrate?
The InChIKey is SLZNGUANRBENFP-UHFFFAOYSA-N. The full InChI is InChI=1S/8CH4.2H2O2.O2.H2O/c;;;;;;;;3*1-2;/h8*1H4;2*1-2H;;1H2.
What are the key properties of hydrogen peroxide;methane;molecular oxygen;hydrate?
hydrogen peroxide;methane;molecular oxygen;hydrate has a molecular weight of 246.39 g/mol, XLogP of 4.37, 0 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for hydrogen peroxide;methane;molecular oxygen;hydrate is sourced from PubChem (CID 169431081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).