hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane

C3H13N2O2S2Sb — CID 174393115

IUPAChydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane
SMILESCSSC.NNC(=O)O.[SbH3]
InChIInChI=1S/C2H6S2.CH4N2O2.Sb.3H/c1-3-4-2;2-3-1(4)5;;;;/h1-2H3;3H,2H2,(H,4,5);;;;
InChIKeyZJSZGUBUVAOZKJ-UHFFFAOYSA-N
MW295.04 g/mol
LogP-0.43
Rot. Bonds1

About hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane

hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane (PubChem CID 174393115) has the molecular formula C3H13N2O2S2Sb and a molecular weight of 295.04 g/mol. Its IUPAC name is hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane.

Molecular Properties

Compound Namehydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane
PubChem CID174393115
Molecular FormulaC3H13N2O2S2Sb
Molecular Weight295.04 g/mol
Exact Mass293.95
IUPAC Namehydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane
SMILESCSSC.NNC(=O)O.[SbH3]
InChIInChI=1S/C2H6S2.CH4N2O2.Sb.3H/c1-3-4-2;2-3-1(4)5;;;;/h1-2H3;3H,2H2,(H,4,5);;;;
InChIKeyZJSZGUBUVAOZKJ-UHFFFAOYSA-N
XLogP-0.43
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.04
LogP ≤ 5-0.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane?
The IUPAC name of hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane (CID 174393115) is hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane.
What is the SMILES notation for hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane?
The canonical SMILES for hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane is CSSC.NNC(=O)O.[SbH3].
What is the InChIKey of hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane?
The InChIKey is ZJSZGUBUVAOZKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6S2.CH4N2O2.Sb.3H/c1-3-4-2;2-3-1(4)5;;;;/h1-2H3;3H,2H2,(H,4,5);;;;.
What are the key properties of hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane?
hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane has a molecular weight of 295.04 g/mol, XLogP of -0.43, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazinecarboxylic acid;(methyldisulfanyl)methane;stibane is sourced from PubChem (CID 174393115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).