CID 154430703

H5N3O8S3 — CID 154430703

IUPAC—
SMILESO=S(O)NN(NS(=O)(=O)O)S(=O)(=O)O
InChIInChI=1S/H5N3O8S3/c4-12(5)1-3(14(9,10)11)2-13(6,7)8/h1-2H,(H,4,5)(H,6,7,8)(H,9,10,11)
InChIKeyHTRTVBVROSPQMZ-UHFFFAOYSA-N
MW271.25 g/mol
LogP-2.96
Rot. Bonds5

About CID 154430703

CID 154430703 (PubChem CID 154430703) has the molecular formula H5N3O8S3 and a molecular weight of 271.25 g/mol.

Molecular Properties

Compound NameCID 154430703
PubChem CID154430703
Molecular FormulaH5N3O8S3
Molecular Weight271.25 g/mol
Exact Mass270.92
IUPAC Name—
SMILESO=S(O)NN(NS(=O)(=O)O)S(=O)(=O)O
InChIInChI=1S/H5N3O8S3/c4-12(5)1-3(14(9,10)11)2-13(6,7)8/h1-2H,(H,4,5)(H,6,7,8)(H,9,10,11)
InChIKeyHTRTVBVROSPQMZ-UHFFFAOYSA-N
XLogP-2.96
TPSA173.34 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.25
LogP ≤ 5-2.96
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 154430703?
The IUPAC name of CID 154430703 (CID 154430703) is not available.
What is the SMILES notation for CID 154430703?
The canonical SMILES for CID 154430703 is O=S(O)NN(NS(=O)(=O)O)S(=O)(=O)O.
What is the InChIKey of CID 154430703?
The InChIKey is HTRTVBVROSPQMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/H5N3O8S3/c4-12(5)1-3(14(9,10)11)2-13(6,7)8/h1-2H,(H,4,5)(H,6,7,8)(H,9,10,11).
What are the key properties of CID 154430703?
CID 154430703 has a molecular weight of 271.25 g/mol, XLogP of -2.96, 5 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 154430703 is sourced from PubChem (CID 154430703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).