CID 161346823

H5O4P — CID 161346823

IUPAC—
SMILESO.OO.[2H]P=O
InChIInChI=1S/H2O2.HOP.H2O/c2*1-2;/h1-2H;2H;1H2/i;2D;
InChIKeyDAXUQBHYPVUOOF-WNEFZCBWSA-N
MW101.02 g/mol
LogP-0.33
Rot. Bonds

About CID 161346823

CID 161346823 (PubChem CID 161346823) has the molecular formula H5O4P and a molecular weight of 101.02 g/mol.

Molecular Properties

Compound NameCID 161346823
PubChem CID161346823
Molecular FormulaH5O4P
Molecular Weight101.02 g/mol
Exact Mass101.00
IUPAC Name—
SMILESO.OO.[2H]P=O
InChIInChI=1S/H2O2.HOP.H2O/c2*1-2;/h1-2H;2H;1H2/i;2D;
InChIKeyDAXUQBHYPVUOOF-WNEFZCBWSA-N
XLogP-0.33
TPSA89.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.02
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 161346823?
The IUPAC name of CID 161346823 (CID 161346823) is not available.
What is the SMILES notation for CID 161346823?
The canonical SMILES for CID 161346823 is O.OO.[2H]P=O.
What is the InChIKey of CID 161346823?
The InChIKey is DAXUQBHYPVUOOF-WNEFZCBWSA-N. The full InChI is InChI=1S/H2O2.HOP.H2O/c2*1-2;/h1-2H;2H;1H2/i;2D;.
What are the key properties of CID 161346823?
CID 161346823 has a molecular weight of 101.02 g/mol, XLogP of -0.33, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 161346823 is sourced from PubChem (CID 161346823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).