CID 158889848

H₆N₂O₃ — CID 158889848

About CID 158889848

CID 158889848 (PubChem CID 158889848) has the molecular formula H₆N₂O₃ and a molecular weight of 82.06 g/mol.

Molecular Properties

• Compound Name: CID 158889848
• PubChem CID: 158889848
• Molecular Formula: H₆N₂O₃
• Molecular Weight: 82.06 g/mol
• Exact Mass: 82.04
• IUPAC Name: —
• SMILES: NN.OOO
• InChI: InChI=1S/H4N2.H2O3/c1-2;1-3-2/h1-2H2;1-2H
• InChIKey: JEBYURNGHSRFRT-UHFFFAOYSA-N
• XLogP: -1.23
• TPSA: 101.73 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 5
• Heavy Atoms: 5
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	82.06
LogP ≤ 5	-1.23
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of CID 158889848?

The IUPAC name of CID 158889848 (CID 158889848) is not available.

What is the SMILES notation for CID 158889848?

The canonical SMILES for CID 158889848 is NN.OOO.

What is the InChIKey of CID 158889848?

The InChIKey is JEBYURNGHSRFRT-UHFFFAOYSA-N. The full InChI is InChI=1S/H4N2.H2O3/c1-2;1-3-2/h1-2H2;1-2H.

What are the key properties of CID 158889848?

CID 158889848 has a molecular weight of 82.06 g/mol, XLogP of -1.23, 0 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for CID 158889848 is sourced from PubChem (CID 158889848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 158889848 — identifiers, structure, computed properties (public domain)

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