CID 131878072

H3Li2O4P — CID 131878072

IUPAC—
SMILESO=P(O)(O)O.[Li].[Li]
InChIInChI=1S/2Li.H3O4P/c;;1-5(2,3)4/h;;(H3,1,2,3,4)
InChIKeyXHNSSSBOZPTFJF-UHFFFAOYSA-N
MW111.88 g/mol
LogP-1.69
Rot. Bonds

About CID 131878072

CID 131878072 (PubChem CID 131878072) has the molecular formula H3Li2O4P and a molecular weight of 111.88 g/mol.

Molecular Properties

Compound NameCID 131878072
PubChem CID131878072
Molecular FormulaH3Li2O4P
Molecular Weight111.88 g/mol
Exact Mass112.01
IUPAC Name—
SMILESO=P(O)(O)O.[Li].[Li]
InChIInChI=1S/2Li.H3O4P/c;;1-5(2,3)4/h;;(H3,1,2,3,4)
InChIKeyXHNSSSBOZPTFJF-UHFFFAOYSA-N
XLogP-1.69
TPSA77.76 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.88
LogP ≤ 5-1.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 159330917
methane;phosphoric acid
CID 18515646
phosphoric acid;hydrate
CID 22023151
phosphane;phosphoric acid
CID 172840180
hydrogen peroxide;phosphoric acid
CID 18509931
CID 159816390
CID 159816390
methane;phosphoric acid
CID 173400304
CID 173050648
CID 173050648
iron;phosphoric acid
CID 174838016
cerium;phosphoric acid
CID 90659592
phosphane;phosphoric acid
CID 173160232
phosphoric acid;xenon
CID 159732465

Frequently Asked Questions

What is the IUPAC name of CID 131878072?
The IUPAC name of CID 131878072 (CID 131878072) is not available.
What is the SMILES notation for CID 131878072?
The canonical SMILES for CID 131878072 is O=P(O)(O)O.[Li].[Li].
What is the InChIKey of CID 131878072?
The InChIKey is XHNSSSBOZPTFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/2Li.H3O4P/c;;1-5(2,3)4/h;;(H3,1,2,3,4).
What are the key properties of CID 131878072?
CID 131878072 has a molecular weight of 111.88 g/mol, XLogP of -1.69, 0 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 131878072 is sourced from PubChem (CID 131878072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).