Showing Compound Sodium phosphate (Na3PO4) (FDB013349)

Record Information

Version

1.0

Creation date

2010-04-08 22:10:40 UTC

Update date

2015-07-20 22:58:06 UTC

Primary ID

FDB013349

Secondary Accession Numbers

Not Available

Chemical Information

FooDB Name

Sodium phosphate (Na3PO4)

Description

trisodium phosphate, also known as NA3PO4 or sodium phosphoric acid, belongs to the class of inorganic compounds known as alkali metal phosphates. These are inorganic compounds in which the largest oxoanion is phosphate, and in which the heaviest atom not in an oxoanion is an alkali metal. Based on a literature review a significant number of articles have been published on trisodium phosphate.

CAS Number

7601-54-9

Structure

MOL SDF PDB SMILES InChI

Synonyms

Synonym	Source
Na3po4	ChEBI
Phosphoric acid trisodium salt	ChEBI
Sodium orthophosphate	ChEBI
Sodium phosphate	ChEBI
Sodium phosphate, tribasic	ChEBI
Tertiaeres natriumphosphat(V)	ChEBI
Tertiary sodium phosphate	ChEBI
Tribasic sodium orthophosphate	ChEBI
Tribasic sodium phosphate	ChEBI
Trinatriumphosphat	ChEBI
Phosphate trisodium salt	Generator
Sodium orthophosphoric acid	Generator
Sodium phosphoric acid	Generator
Sodium phosphoric acid, tribasic	Generator
Tertiary sodium phosphoric acid	Generator
Tribasic sodium orthophosphoric acid	Generator
Tribasic sodium phosphoric acid	Generator
Trisodium phosphoric acid	Generator
Sodium phosphoric acid (na3po4)	Generator
Neutral sodium hydrogen phosphate	MeSH
Phosphoric acid, disodium salt	MeSH
Phosphoric acid, disodium salt, 32P-labeled	MeSH
Phosphoric acid, disodium salt, heptahydrate	MeSH
Sodium dihydrogen orthophosphate	MeSH
Sodium phosphate monobasic anhydrous	MeSH
Sodium phosphate, dibasic	MeSH
Sodium phosphate, tribasic, dodecahydrate	MeSH
Trisodium phosphate dodecahydrate	MeSH
Phosphoric acid, disodium salt, anhydrous	MeSH
Phosphoric acid, monosodium salt	MeSH
Phosphoric acid, monosodium salt, anhydrous	MeSH
Sodium hydrophosphate	MeSH
Sodium phosphate, dibasic (anhydrous)	MeSH
Sodium phosphate, disodium salt	MeSH
Disodium acid phosphate	MeSH
Monosodium dihydrogen phosphate	MeSH
Phosphoric acid, disodium salt, dodecahydrate	MeSH
Phosphoric acid, sodium salt	MeSH
Phosphoric acid, trisodium salt	MeSH
Phosphoric acid, trisodium salt , 32P-labeled	MeSH
Sodium biphosphate	MeSH
Sodium dihydrogen phosphate	MeSH
Sodium phosphate, monobasic anhydrous	MeSH
Dibasic sodium phosphate, anhydrous	MeSH
Disodium hydrogen phosphate	MeSH
Disodium hydrogen phosphate anhydrous	MeSH
Phosphoric acid, sodium (2:3) salt	MeSH
Phosphoric acid, trisodium salt , dodecahydrate	MeSH
Sodium phosphate, monobasic	MeSH
Sodium orthophosphate, tribasic	biospider
Sodium phosphate tribasic	biospider
Sodium tertiary phosphate	biospider
Trisodium orthophosphate	biospider
Trisodium phosphate	biospider
Trisodium phosphate, 9CI, 8CI	db_source
Trisodium trihydrogen bis(phosphate)	biospider

Predicted Properties

Property	Value	Source
logP	-1	ChemAxon
pKa (Strongest Acidic)	1.8	ChemAxon
Physiological Charge	-2	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	86.25 Å²	ChemAxon
Rotatable Bond Count	0	ChemAxon
Refractivity	11.29 m³·mol⁻¹	ChemAxon
Polarizability	4.93 Å³	ChemAxon
Number of Rings	0	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Chemical Formula

Na3O4P

IUPAC name

trisodium phosphate

InChI Identifier

InChI=1S/3Na.H3O4P/c;;;1-5(2,3)4/h;;;(H3,1,2,3,4)/q3*+1;/p-3

InChI Key

RYFMWSXOAZQYPI-UHFFFAOYSA-K

Isomeric SMILES

[Na+].[Na+].[Na+].[O-]P([O-])([O-])=O

Average Molecular Weight

163.9407

Monoisotopic Molecular Weight

163.922729025

Classification

Description

Belongs to the class of inorganic compounds known as alkali metal phosphates. These are inorganic compounds in which the largest oxoanion is phosphate, and in which the heaviest atom not in an oxoanion is an alkali metal.

Kingdom

Inorganic compounds

Super Class

Mixed metal/non-metal compounds

Class

Alkali metal oxoanionic compounds

Sub Class

Alkali metal phosphates

Direct Parent

Alkali metal phosphates

Alternative Parents

Substituents

Alkali metal phosphate
Inorganic sodium salt
Inorganic oxide
Inorganic salt

Molecular Framework

Not Available

External Descriptors

sodium phosphate (CHEBI:37583 )

Ontology

No ontology term

Physico-Chemical Properties

Physico-Chemical Properties - Experimental

Property	Value	Reference
Physical state	Not Available
Physical Description	Not Available
Mass Composition	Na 42.07%; O 39.04%; P 18.89%	DFC
Melting Point	Mp 1583°	DFC
Boiling Point	Not Available
Experimental Water Solubility	Not Available
Experimental logP	Not Available
Experimental pKa	Not Available
Isoelectric point	Not Available
Charge	Not Available
Optical Rotation	Not Available
Spectroscopic UV Data	Not Available
Density	Not Available
Refractive Index	Not Available

Spectra

EI-MS/GC-MS

Not Available

MS/MS

Type	Description	Splash Key	View
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 10V, Positive	splash10-03di-0900000000-05fc18bba1620cc9731f	2019-02-22	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 20V, Positive	splash10-03di-0900000000-05fc18bba1620cc9731f	2019-02-22	View Spectrum
Predicted MS/MS	Predicted LC-MS/MS Spectrum - 40V, Positive	splash10-03di-0900000000-05fc18bba1620cc9731f	2019-02-22	View Spectrum

NMR

Not Available

External Links

ChemSpider ID

Not Available

ChEMBL ID

Not Available

KEGG Compound ID

Not Available

Pubchem Compound ID

24243

Pubchem Substance ID

Not Available

ChEBI ID

37583

Phenol-Explorer ID

Not Available

DrugBank ID

Not Available

HMDB ID

Not Available

CRC / DFC (Dictionary of Food Compounds) ID

HTL97-K:HTL97-K

EAFUS ID

3468

Dr. Duke ID

Not Available

BIGG ID

Not Available

KNApSAcK ID

Not Available

HET ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

Flavornet ID

Not Available

GoodScent ID

rw1283731

SuperScent ID

Not Available

Wikipedia ID

Trisodium_phosphate

Phenol-Explorer Metabolite ID

Not Available

Duplicate IDS

Not Available

Old DFC IDS

Not Available

Associated Foods

Food	Content Range	Average	Reference
Food			Reference

Biological Effects and Interactions

Health Effects / Bioactivities

Not Available

Enzymes

Not Available

Pathways

Not Available

Metabolism

Not Available

Biosynthesis

Not Available

Organoleptic Properties

Flavours

Flavor	Citations
odorless	The Good Scents Company (2009). Flavor and fragrance information catalog. <http://www.thegoodscentscompany.com/allprod.html> Accessed 15.10.23.

Files

MSDS

Not Available

References

Synthesis Reference

Not Available

General Reference

Not Available

Content Reference