CID 157485164

H4NaO6P2 — CID 157485164

IUPAC—
SMILESO=P(O)(O)P(=O)(O)O.[Na]
InChIInChI=1S/Na.H4O6P2/c;1-7(2,3)8(4,5)6/h;(H2,1,2,3)(H2,4,5,6)
InChIKeyBWPYPJCULGTIAP-UHFFFAOYSA-N
MW184.96 g/mol
LogP-1.12
Rot. Bonds1

About CID 157485164

CID 157485164 (PubChem CID 157485164) has the molecular formula H4NaO6P2 and a molecular weight of 184.96 g/mol.

Molecular Properties

Compound NameCID 157485164
PubChem CID157485164
Molecular FormulaH4NaO6P2
Molecular Weight184.96 g/mol
Exact Mass184.94
IUPAC Name—
SMILESO=P(O)(O)P(=O)(O)O.[Na]
InChIInChI=1S/Na.H4O6P2/c;1-7(2,3)8(4,5)6/h;(H2,1,2,3)(H2,4,5,6)
InChIKeyBWPYPJCULGTIAP-UHFFFAOYSA-N
XLogP-1.12
TPSA115.06 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.96
LogP ≤ 5-1.12
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 157485164?
The IUPAC name of CID 157485164 (CID 157485164) is not available.
What is the SMILES notation for CID 157485164?
The canonical SMILES for CID 157485164 is O=P(O)(O)P(=O)(O)O.[Na].
What is the InChIKey of CID 157485164?
The InChIKey is BWPYPJCULGTIAP-UHFFFAOYSA-N. The full InChI is InChI=1S/Na.H4O6P2/c;1-7(2,3)8(4,5)6/h;(H2,1,2,3)(H2,4,5,6).
What are the key properties of CID 157485164?
CID 157485164 has a molecular weight of 184.96 g/mol, XLogP of -1.12, 1 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 157485164 is sourced from PubChem (CID 157485164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).