Anhydrous sodium dihydrogen phosphate, for HPLC

HNaO4P — CID 155882682

IUPAC—
SMILESO=[P+]([O-])OO.[Na]
InChIInChI=1S/Na.HO4P/c;1-4-5(2)3/h;1H
InChIKeyIQCSMHYWGXTMFI-UHFFFAOYSA-N
MW118.97 g/mol
LogP-0.89
Rot. Bonds1

About Anhydrous sodium dihydrogen phosphate, for HPLC

Anhydrous sodium dihydrogen phosphate, for HPLC (PubChem CID 155882682) has the molecular formula HNaO4P and a molecular weight of 118.97 g/mol.

Molecular Properties

Compound NameAnhydrous sodium dihydrogen phosphate, for HPLC
PubChem CID155882682
Molecular FormulaHNaO4P
Molecular Weight118.97 g/mol
Exact Mass118.95
IUPAC Name—
SMILESO=[P+]([O-])OO.[Na]
InChIInChI=1S/Na.HO4P/c;1-4-5(2)3/h;1H
InChIKeyIQCSMHYWGXTMFI-UHFFFAOYSA-N
XLogP-0.89
TPSA69.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.97
LogP ≤ 5-0.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 Anhydrous sodium dihydrogen phosphate, for HPLC?
The IUPAC name of Anhydrous sodium dihydrogen phosphate, for HPLC (CID 155882682) is not available.
What is the SMILES notation for Anhydrous sodium dihydrogen phosphate, for HPLC?
The canonical SMILES for Anhydrous sodium dihydrogen phosphate, for HPLC is O=[P+]([O-])OO.[Na].
What is the InChIKey of Anhydrous sodium dihydrogen phosphate, for HPLC?
The InChIKey is IQCSMHYWGXTMFI-UHFFFAOYSA-N. The full InChI is InChI=1S/Na.HO4P/c;1-4-5(2)3/h;1H.
What are the key properties of Anhydrous sodium dihydrogen phosphate, for HPLC?
Anhydrous sodium dihydrogen phosphate, for HPLC has a molecular weight of 118.97 g/mol, XLogP of -0.89, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for Anhydrous sodium dihydrogen phosphate, for HPLC is sourced from PubChem (CID 155882682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).