[bis(methylperoxy)amino]peroxymethane

C3H9NO6 — CID 170567085

IUPAC[bis(methylperoxy)amino]peroxymethane
SMILESCOON(OOC)OOC
InChIInChI=1S/C3H9NO6/c1-5-8-4(9-6-2)10-7-3/h1-3H3
InChIKeyIYLGVWFLZJIMCY-UHFFFAOYSA-N
MW155.11 g/mol
LogP-0.23
Rot. Bonds6

About [bis(methylperoxy)amino]peroxymethane

[bis(methylperoxy)amino]peroxymethane (PubChem CID 170567085) has the molecular formula C3H9NO6 and a molecular weight of 155.11 g/mol. Its IUPAC name is [bis(methylperoxy)amino]peroxymethane.

Molecular Properties

Compound Name[bis(methylperoxy)amino]peroxymethane
PubChem CID170567085
Molecular FormulaC3H9NO6
Molecular Weight155.11 g/mol
Exact Mass155.04
IUPAC Name[bis(methylperoxy)amino]peroxymethane
SMILESCOON(OOC)OOC
InChIInChI=1S/C3H9NO6/c1-5-8-4(9-6-2)10-7-3/h1-3H3
InChIKeyIYLGVWFLZJIMCY-UHFFFAOYSA-N
XLogP-0.23
TPSA58.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.11
LogP ≤ 5-0.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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 [bis(methylperoxy)amino]peroxymethane?
The IUPAC name of [bis(methylperoxy)amino]peroxymethane (CID 170567085) is [bis(methylperoxy)amino]peroxymethane.
What is the SMILES notation for [bis(methylperoxy)amino]peroxymethane?
The canonical SMILES for [bis(methylperoxy)amino]peroxymethane is COON(OOC)OOC.
What is the InChIKey of [bis(methylperoxy)amino]peroxymethane?
The InChIKey is IYLGVWFLZJIMCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO6/c1-5-8-4(9-6-2)10-7-3/h1-3H3.
What are the key properties of [bis(methylperoxy)amino]peroxymethane?
[bis(methylperoxy)amino]peroxymethane has a molecular weight of 155.11 g/mol, XLogP of -0.23, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [bis(methylperoxy)amino]peroxymethane is sourced from PubChem (CID 170567085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).