EcoDrugPlus


Keyword(s):	Food Contact Chemicals
Molecule Category	Salt-form
EPA CompTox	DTXSID0064969

Keyword(s):

Food Contact Chemicals

Molecule Category

Salt-form

EPA CompTox

DTXSID0064969


InChI Key	LVXHNCUCBXIIPE-UHFFFAOYSA-L
Smiles	O.[Na+].[Na+].OP([O-])([O-])=O
InChI	InChI=1S/2Na.H3O4P.H2O/c;;1-5(2,3)4;/h;;(H3,1,2,3,4);1H2/q2*+1;;/p-2

InChI Key

LVXHNCUCBXIIPE-UHFFFAOYSA-L

Smiles

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

InChI

InChI=1S/2Na.H3O4P.H2O/c;;1-5(2,3)4;/h;;(H3,1,2,3,4);1H2/q2*+1;;/p-2

Property Name	Value
Molecular Formula	H3Na2O5P
Molecular Weight	159.95
AlogP	-9.01
Hydrogen Bond Acceptor	3.0
Hydrogen Bond Donor	1.0
Polar Surface Area	114.92
Heavy Atoms	8.0

Property Name

Value

Molecular Formula

H3Na2O5P

Molecular Weight

159.95

AlogP

-9.01

Hydrogen Bond Acceptor

3.0

Hydrogen Bond Donor

1.0

Polar Surface Area

114.92

Heavy Atoms

8.0

Resources	Reference
CAS NUMBER	10140-65-5
NORMAN SUSDAT
PubChem	61488

Resources

Reference

CAS NUMBER

10140-65-5

NORMAN SUSDAT

PubChem

61488

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

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Last update: Monday, 3 November 2025

DISODIUM PHOSPHATE HYDRATE

Structure

Physicochemical Descriptors

Cross References