1-hydrazinylethane-1,2-dithiol

C2H8N2S2 — CID 123824831

IUPAC1-hydrazinylethane-1,2-dithiol
SMILESNNC(S)CS
InChIInChI=1S/C2H8N2S2/c3-4-2(6)1-5/h2,4-6H,1,3H2
InChIKeyVZDAQIWUOJLBSR-UHFFFAOYSA-N
MW124.23 g/mol
LogP-0.36
Rot. Bonds2

About 1-hydrazinylethane-1,2-dithiol

1-hydrazinylethane-1,2-dithiol (PubChem CID 123824831) has the molecular formula C2H8N2S2 and a molecular weight of 124.23 g/mol. Its IUPAC name is 1-hydrazinylethane-1,2-dithiol.

Molecular Properties

Compound Name1-hydrazinylethane-1,2-dithiol
PubChem CID123824831
Molecular FormulaC2H8N2S2
Molecular Weight124.23 g/mol
Exact Mass124.01
IUPAC Name1-hydrazinylethane-1,2-dithiol
SMILESNNC(S)CS
InChIInChI=1S/C2H8N2S2/c3-4-2(6)1-5/h2,4-6H,1,3H2
InChIKeyVZDAQIWUOJLBSR-UHFFFAOYSA-N
XLogP-0.36
TPSA38.05 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.23
LogP ≤ 5-0.36
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-hydrazinylethane-1,2-dithiol?
The IUPAC name of 1-hydrazinylethane-1,2-dithiol (CID 123824831) is 1-hydrazinylethane-1,2-dithiol.
What is the SMILES notation for 1-hydrazinylethane-1,2-dithiol?
The canonical SMILES for 1-hydrazinylethane-1,2-dithiol is NNC(S)CS.
What is the InChIKey of 1-hydrazinylethane-1,2-dithiol?
The InChIKey is VZDAQIWUOJLBSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8N2S2/c3-4-2(6)1-5/h2,4-6H,1,3H2.
What are the key properties of 1-hydrazinylethane-1,2-dithiol?
1-hydrazinylethane-1,2-dithiol has a molecular weight of 124.23 g/mol, XLogP of -0.36, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydrazinylethane-1,2-dithiol is sourced from PubChem (CID 123824831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).