SODIUM AMINOTRIS(METHYLENEPHOSPHONATE)

Details

Stereochemistry	ACHIRAL
Molecular Formula	C3H11NO9P3.Na
Molecular Weight	321.0318
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SODIUM AMINOTRIS(METHYLENEPHOSPHONATE)

Structure Search

SMILES

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

InChI

InChIKey=RCUMDGGJOOTRBS-UHFFFAOYSA-M

InChI=1S/C3H12NO9P3.Na/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;+1/p-1

HIDE SMILES / InChI

Molecular Formula	C3H11NO9P3
Molecular Weight	298.042
Charge	-1
Count

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

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

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
Potentiometric studies of binary and ternary complexes involving cadmium(II) and nitrilo-tris(methyl phosphonic acid) with amino acids, peptides and DNA constituents.	2007 Aug	17899886

Substance Class	Chemical Created by `admin` on `Fri Dec 15 20:41:02 GMT 2023` Edited by `admin` on `Fri Dec 15 20:41:02 GMT 2023`
Record UNII	9HON9B633X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SODIUM AMINOTRIS(METHYLENEPHOSPHONATE)

Common Name

English

NITRILOTRI(METHYLENEPHOSPHONIC ACID) SODIUM SALT

Systematic Name

English

SODIUM NITRILOTRIMETHYLENEPHOSPHONATE

Systematic Name

English

TRIS(PHOSPHONOMETHYL)AMINE SODIUM SALT

Systematic Name

English

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

Common Name

English

SODIUM(NITRILOTRIS(METHYLENE))TRISPHOSPHONATE

Systematic Name

English

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

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID20873435