CID 57473081

HNO2S- — CID 57473081

IUPAC—
SMILES[NH]S(=O)[O-]
InChIInChI=1S/H2NO2S/c1-4(2)3/h1H,(H,2,3)/p-1
InChIKeyXRORKZBHUILEMK-UHFFFAOYSA-M
MW79.08 g/mol
LogP-0.94
Rot. Bonds

About CID 57473081

CID 57473081 (PubChem CID 57473081) has the molecular formula HNO2S- and a molecular weight of 79.08 g/mol.

Molecular Properties

Compound NameCID 57473081
PubChem CID57473081
Molecular FormulaHNO2S-
Molecular Weight79.08 g/mol
Exact Mass78.97
IUPAC Name—
SMILES[NH]S(=O)[O-]
InChIInChI=1S/H2NO2S/c1-4(2)3/h1H,(H,2,3)/p-1
InChIKeyXRORKZBHUILEMK-UHFFFAOYSA-M
XLogP-0.94
TPSA63.93 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50079.08
LogP ≤ 5-0.94
H-Bond Donors ≤ 50
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 57473081?
The IUPAC name of CID 57473081 (CID 57473081) is not available.
What is the SMILES notation for CID 57473081?
The canonical SMILES for CID 57473081 is [NH]S(=O)[O-].
What is the InChIKey of CID 57473081?
The InChIKey is XRORKZBHUILEMK-UHFFFAOYSA-M. The full InChI is InChI=1S/H2NO2S/c1-4(2)3/h1H,(H,2,3)/p-1.
What are the key properties of CID 57473081?
CID 57473081 has a molecular weight of 79.08 g/mol, XLogP of -0.94, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57473081 is sourced from PubChem (CID 57473081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).