CID 22145507

HNO3S2 — CID 22145507

IUPAC—
SMILESO=S=NS(=O)O
InChIInChI=1S/HNO3S2/c2-5-1-6(3)4/h(H,3,4)
InChIKeyXJJZFKBFQOFEJL-UHFFFAOYSA-N
MW127.15 g/mol
LogP-0.48
Rot. Bonds1

About CID 22145507

CID 22145507 (PubChem CID 22145507) has the molecular formula HNO3S2 and a molecular weight of 127.15 g/mol.

Molecular Properties

Compound NameCID 22145507
PubChem CID22145507
Molecular FormulaHNO3S2
Molecular Weight127.15 g/mol
Exact Mass126.94
IUPAC Name—
SMILESO=S=NS(=O)O
InChIInChI=1S/HNO3S2/c2-5-1-6(3)4/h(H,3,4)
InChIKeyXJJZFKBFQOFEJL-UHFFFAOYSA-N
XLogP-0.48
TPSA66.73 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.15
LogP ≤ 5-0.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 22145507?
The IUPAC name of CID 22145507 (CID 22145507) is not available.
What is the SMILES notation for CID 22145507?
The canonical SMILES for CID 22145507 is O=S=NS(=O)O.
What is the InChIKey of CID 22145507?
The InChIKey is XJJZFKBFQOFEJL-UHFFFAOYSA-N. The full InChI is InChI=1S/HNO3S2/c2-5-1-6(3)4/h(H,3,4).
What are the key properties of CID 22145507?
CID 22145507 has a molecular weight of 127.15 g/mol, XLogP of -0.48, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22145507 is sourced from PubChem (CID 22145507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).