(E)-hydrazinylidenesulfamic acid

H3N3O3S — CID 18000562

IUPAC(E)-hydrazinylidenesulfamic acid
SMILESN/N=N/S(=O)(=O)O
InChIInChI=1S/H3N3O3S/c1-2-3-7(4,5)6/h(H2,1,3)(H,4,5,6)
InChIKeyQGCCEFRDKCNAJA-UHFFFAOYSA-N
MW125.11 g/mol
LogP-0.88
Rot. Bonds1

About (E)-hydrazinylidenesulfamic acid

(E)-hydrazinylidenesulfamic acid (PubChem CID 18000562) has the molecular formula H3N3O3S and a molecular weight of 125.11 g/mol. Its IUPAC name is (E)-hydrazinylidenesulfamic acid.

Molecular Properties

Compound Name(E)-hydrazinylidenesulfamic acid
PubChem CID18000562
Molecular FormulaH3N3O3S
Molecular Weight125.11 g/mol
Exact Mass124.99
IUPAC Name(E)-hydrazinylidenesulfamic acid
SMILESN/N=N/S(=O)(=O)O
InChIInChI=1S/H3N3O3S/c1-2-3-7(4,5)6/h(H2,1,3)(H,4,5,6)
InChIKeyQGCCEFRDKCNAJA-UHFFFAOYSA-N
XLogP-0.88
TPSA105.11 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.11
LogP ≤ 5-0.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-hydrazinylidenesulfamic acid?
The IUPAC name of (E)-hydrazinylidenesulfamic acid (CID 18000562) is (E)-hydrazinylidenesulfamic acid.
What is the SMILES notation for (E)-hydrazinylidenesulfamic acid?
The canonical SMILES for (E)-hydrazinylidenesulfamic acid is N/N=N/S(=O)(=O)O.
What is the InChIKey of (E)-hydrazinylidenesulfamic acid?
The InChIKey is QGCCEFRDKCNAJA-UHFFFAOYSA-N. The full InChI is InChI=1S/H3N3O3S/c1-2-3-7(4,5)6/h(H2,1,3)(H,4,5,6).
What are the key properties of (E)-hydrazinylidenesulfamic acid?
(E)-hydrazinylidenesulfamic acid has a molecular weight of 125.11 g/mol, XLogP of -0.88, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-hydrazinylidenesulfamic acid is sourced from PubChem (CID 18000562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).