CID 154051829

HO2PS — CID 154051829

IUPAC—
SMILESO=POS
InChIInChI=1S/HO2PS/c1-3-2-4/h4H
InChIKeyKCDMFYZUAQLVSA-UHFFFAOYSA-N
MW96.05 g/mol
LogP1.05
Rot. Bonds1

About CID 154051829

CID 154051829 (PubChem CID 154051829) has the molecular formula HO2PS and a molecular weight of 96.05 g/mol.

Molecular Properties

Compound NameCID 154051829
PubChem CID154051829
Molecular FormulaHO2PS
Molecular Weight96.05 g/mol
Exact Mass95.94
IUPAC Name—
SMILESO=POS
InChIInChI=1S/HO2PS/c1-3-2-4/h4H
InChIKeyKCDMFYZUAQLVSA-UHFFFAOYSA-N
XLogP1.05
TPSA26.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.05
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'sulfur_oxygen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 154051829?
The IUPAC name of CID 154051829 (CID 154051829) is not available.
What is the SMILES notation for CID 154051829?
The canonical SMILES for CID 154051829 is O=POS.
What is the InChIKey of CID 154051829?
The InChIKey is KCDMFYZUAQLVSA-UHFFFAOYSA-N. The full InChI is InChI=1S/HO2PS/c1-3-2-4/h4H.
What are the key properties of CID 154051829?
CID 154051829 has a molecular weight of 96.05 g/mol, XLogP of 1.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 154051829 is sourced from PubChem (CID 154051829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).