formaldehyde;(methoxyamino)oxymethane

C3H9NO3 — CID 174911263

IUPACformaldehyde;(methoxyamino)oxymethane
SMILESC=O.CONOC
InChIInChI=1S/C2H7NO2.CH2O/c1-4-3-5-2;1-2/h3H,1-2H3;1H2
InChIKeyASLIIQUNQIUUBX-UHFFFAOYSA-N
MW107.11 g/mol
LogP-0.49
Rot. Bonds2

About formaldehyde;(methoxyamino)oxymethane

formaldehyde;(methoxyamino)oxymethane (PubChem CID 174911263) has the molecular formula C3H9NO3 and a molecular weight of 107.11 g/mol. Its IUPAC name is formaldehyde;(methoxyamino)oxymethane.

Molecular Properties

Compound Nameformaldehyde;(methoxyamino)oxymethane
PubChem CID174911263
Molecular FormulaC3H9NO3
Molecular Weight107.11 g/mol
Exact Mass107.06
IUPAC Nameformaldehyde;(methoxyamino)oxymethane
SMILESC=O.CONOC
InChIInChI=1S/C2H7NO2.CH2O/c1-4-3-5-2;1-2/h3H,1-2H3;1H2
InChIKeyASLIIQUNQIUUBX-UHFFFAOYSA-N
XLogP-0.49
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.11
LogP ≤ 5-0.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of formaldehyde;(methoxyamino)oxymethane?
The IUPAC name of formaldehyde;(methoxyamino)oxymethane (CID 174911263) is formaldehyde;(methoxyamino)oxymethane.
What is the SMILES notation for formaldehyde;(methoxyamino)oxymethane?
The canonical SMILES for formaldehyde;(methoxyamino)oxymethane is C=O.CONOC.
What is the InChIKey of formaldehyde;(methoxyamino)oxymethane?
The InChIKey is ASLIIQUNQIUUBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7NO2.CH2O/c1-4-3-5-2;1-2/h3H,1-2H3;1H2.
What are the key properties of formaldehyde;(methoxyamino)oxymethane?
formaldehyde;(methoxyamino)oxymethane has a molecular weight of 107.11 g/mol, XLogP of -0.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;(methoxyamino)oxymethane is sourced from PubChem (CID 174911263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).