carbonic acid;methylperoxymethane

C4H10O8 — CID 23448344

IUPACcarbonic acid;methylperoxymethane
SMILESCOOC.O=C(O)O.O=C(O)O
InChIInChI=1S/C2H6O2.2CH2O3/c1-3-4-2;2*2-1(3)4/h1-2H3;2*(H2,2,3,4)
InChIKeyLPDYDWRRZXEPCL-UHFFFAOYSA-N
MW186.12 g/mol
LogP0.64
Rot. Bonds1

About carbonic acid;methylperoxymethane

carbonic acid;methylperoxymethane (PubChem CID 23448344) has the molecular formula C4H10O8 and a molecular weight of 186.12 g/mol. Its IUPAC name is carbonic acid;methylperoxymethane.

Molecular Properties

Compound Namecarbonic acid;methylperoxymethane
PubChem CID23448344
Molecular FormulaC4H10O8
Molecular Weight186.12 g/mol
Exact Mass186.04
IUPAC Namecarbonic acid;methylperoxymethane
SMILESCOOC.O=C(O)O.O=C(O)O
InChIInChI=1S/C2H6O2.2CH2O3/c1-3-4-2;2*2-1(3)4/h1-2H3;2*(H2,2,3,4)
InChIKeyLPDYDWRRZXEPCL-UHFFFAOYSA-N
XLogP0.64
TPSA133.52 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.12
LogP ≤ 50.64
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze carbonic acid;methylperoxymethane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of carbonic acid;methylperoxymethane?
The IUPAC name of carbonic acid;methylperoxymethane (CID 23448344) is carbonic acid;methylperoxymethane.
What is the SMILES notation for carbonic acid;methylperoxymethane?
The canonical SMILES for carbonic acid;methylperoxymethane is COOC.O=C(O)O.O=C(O)O.
What is the InChIKey of carbonic acid;methylperoxymethane?
The InChIKey is LPDYDWRRZXEPCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O2.2CH2O3/c1-3-4-2;2*2-1(3)4/h1-2H3;2*(H2,2,3,4).
What are the key properties of carbonic acid;methylperoxymethane?
carbonic acid;methylperoxymethane has a molecular weight of 186.12 g/mol, XLogP of 0.64, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;methylperoxymethane is sourced from PubChem (CID 23448344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).