oxo-bis(sulfinatoamino)methane

CH2N2O5S2-2 — CID 19027581

IUPACoxo-bis(sulfinatoamino)methane
SMILESO=C(NS(=O)[O-])NS(=O)[O-]
InChIInChI=1S/CH4N2O5S2/c4-1(2-9(5)6)3-10(7)8/h(H,5,6)(H,7,8)(H2,2,3,4)/p-2
InChIKeyPSYZUCWNPZESLN-UHFFFAOYSA-L
MW186.17 g/mol
LogP-2.13
Rot. Bonds2

About oxo-bis(sulfinatoamino)methane

oxo-bis(sulfinatoamino)methane (PubChem CID 19027581) has the molecular formula CH2N2O5S2-2 and a molecular weight of 186.17 g/mol. Its IUPAC name is oxo-bis(sulfinatoamino)methane.

Molecular Properties

Compound Nameoxo-bis(sulfinatoamino)methane
PubChem CID19027581
Molecular FormulaCH2N2O5S2-2
Molecular Weight186.17 g/mol
Exact Mass185.94
IUPAC Nameoxo-bis(sulfinatoamino)methane
SMILESO=C(NS(=O)[O-])NS(=O)[O-]
InChIInChI=1S/CH4N2O5S2/c4-1(2-9(5)6)3-10(7)8/h(H,5,6)(H,7,8)(H2,2,3,4)/p-2
InChIKeyPSYZUCWNPZESLN-UHFFFAOYSA-L
XLogP-2.13
TPSA121.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.17
LogP ≤ 5-2.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}

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Related Compounds

Sufonylurea
CID 21618712
Sulfamoylsulfonylurea
CID 54118048
1-Sulfamoyl-3-sulfonylurea
CID 20231535
Amino-oxo-(sulfinatosulfonylamino)methane
CID 21647019
1-Sulfanyl-3-sulfonylurea
CID 22564727
Amino-(disulfinatoamino)-oxomethane
CID 57084607
CID 57089382
CID 57089382
Amino-oxo-[sulfamoyl(sulfinato)amino]methane
CID 57254178
Carbamoyl-sulfido-sulfonylazanium
CID 136445811
(Sulfonylamino)sulfonylurea
CID 150349786
[Oxo(sulfanylidene)-lambda6-sulfanylidene]urea
CID 168928278
(Sulfonylamino)sulfanylurea
CID 174948359

Frequently Asked Questions

What is the IUPAC name of oxo-bis(sulfinatoamino)methane?
The IUPAC name of oxo-bis(sulfinatoamino)methane (CID 19027581) is oxo-bis(sulfinatoamino)methane.
What is the SMILES notation for oxo-bis(sulfinatoamino)methane?
The canonical SMILES for oxo-bis(sulfinatoamino)methane is O=C(NS(=O)[O-])NS(=O)[O-].
What is the InChIKey of oxo-bis(sulfinatoamino)methane?
The InChIKey is PSYZUCWNPZESLN-UHFFFAOYSA-L. The full InChI is InChI=1S/CH4N2O5S2/c4-1(2-9(5)6)3-10(7)8/h(H,5,6)(H,7,8)(H2,2,3,4)/p-2.
What are the key properties of oxo-bis(sulfinatoamino)methane?
oxo-bis(sulfinatoamino)methane has a molecular weight of 186.17 g/mol, XLogP of -2.13, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for oxo-bis(sulfinatoamino)methane is sourced from PubChem (CID 19027581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).