TETRASODIUM (NITRILOTRIS(METHYLENE))TRISPHOSPHONATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C3H8NO9P3.4Na
Molecular Weight	386.9773
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of TETRASODIUM (NITRILOTRIS(METHYLENE))TRISPHOSPHONATE

Structure Search

SMILES

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

InChI

InChIKey=CXKLLWYSNDLIRU-UHFFFAOYSA-J

InChI=1S/C3H12NO9P3.4Na/c5-14(6,7)1-4(2-15(8,9)10)3-16(11,12)13;;;;/h1-3H2,(H2,5,6,7)(H2,8,9,10)(H2,11,12,13);;;;/q;4*+1/p-4

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C3H8NO9P3
Molecular Weight	295.0182
Charge	-4
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: http://www.dequest.com/phosphonates/dequest-2000-series/dequest-2006 | Winter, R. (2010) A Consumer's Dictionary of Cosmetic Ingredients, retrieved from: https://books.google.ru/books?id=nTvrEGi_AMoC

Pentasodium aminotrimethylene phosphonate (Dequest® 2006) is a general purpose, cost-effective scale inhibitor based on amino tri methylene phosphonic acid pentasodium salt. Dequest® 2006 provides corrosion inhibition with zinc and phosphates and is a good chelant. In cosmetics, pentasodium aminotrimethylene phosphonate is used as an emulsifier.

Approval Year

PubMed

Title	Date	PubMed
Bilateral infiltrative orbital disease: is it chemically induced?	2008 Oct	18982043
Adsorptive removal of nitrilotris(methylenephosphonic acid) antiscalant from membrane concentrates by iron-coated waste filtration sand.	2010 Oct 15	20667427

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:14:53 GMT 2023` Edited by `admin` on `Sat Dec 16 08:14:53 GMT 2023`
Record UNII	7W7PN3133W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TETRASODIUM (NITRILOTRIS(METHYLENE))TRISPHOSPHONATE

Systematic Name

English

TETRASODIUM AMINOTRIS(METHYLENEPHOSPHONATE)

Common Name

English

PHOSPHONIC ACID, P,P',P''-(NITRILOTRIS(METHYLENE))TRIS-, SODIUM SALT (1:4)

Systematic Name

English

NITRILOTRIS(METHYLENEPHOSPHONIC ACID) TETRASODIUM SALT

Systematic Name

English

PHOSPHONIC ACID, (NITRILOTRIS(METHYLENE))TRIS-, TETRASODIUM SALT

Common Name

English

Code System Code Type Description

PUBCHEM

14367516