Amino tris(methylene phosphonic acid) structure

3D Mol Similar

Amino tris(methylene phosphonic acid)

: Iupac Name：[bis(phosphonomethyl)amino]methylphosphonic acid; CAS No.: 6419-19-8; Molecular Weight：299.05000; Modify Date.: 2023-02-12 06:55; Introduction: It is used for power plants, refineries, petrochemicals, fertilizer plant cooling water, oil field injection water system,particularly suitable for hard high-calcium, low concentration multiple systems, such as power plants and high hardness high salinity, bad water quality conditions of the oil pipeline inhibitors,which may decrease the risk of corrosion and scaling of metal equipment and pipeline. In the textile printing and dyeing industry,Amino tris(methylene phosphonic acid) is used as a metal ion chelating agent, metal surface treatment agent. View more+

Request For Quotation

1. Names and Identifiers

: 1.1 Name; Amino tris(methylene phosphonic acid); 1.2 Synonyms; (nitrilotrimethanediyl)tris(phosphonic acid) (Nitrilotris(methylene))triphosphonic acid [Nitrilotris(methylene)]tris(phosphonic acid) 4-01-00-03070 Amino tris (methylene phosphonic acid) Aminotri(methylene phosphonic acid) Aminotris(methanephosphonic acid) Aminotris(methylphosphonic acid) Ammonium hydrogen [nitrilotris(methylene)]tris(phosphonate) (3:3:1) ATMP ATMPA Briquest 301 BRIQUEST 301-50A Dequest 2000 dowelll37 EINECS 229-146-5 ferrofos509 MFCD00002138 N,N,N-triphosphonomethyl amine N_Tf NITRILOTRI(METHYLPHOSPHONIC ACID) NITRILOTRIMETHANEPHOSPHONIC ACID nitrilotrimethylenephosphonic acid NITRILOTRIS(METHYLENE)TRIPHOSPHONIC ACID NITRILOTRIS(METHYLENEPHOSPHONIC ACID) ntpo phosphonate, P,P',P''-[nitrilotris(methylene)]tris-, ammonium hydrogen salt (1:3:3) Phosphonate, P-[[[(hydroxyphosphinato)methyl](phosphonomethyl)amino]methyl]-, ammonium salt (1:3) Phosphonic acid, (nitrilotris(methylene))tris-, triammonium salt Phosphonic acid, [nitrilotris(methylene)]tris- Triammonium ({[(hydroxyphosphinato)methyl](phosphonomethyl)amino}methyl)phosphonate Triammonium trihydrogen (nitrilotris(methylene))trisphosphonate triammonium trihydrogen [nitrilotris(methylene)]trisphosphonate TRIS(PHOSPHONOMETHYL)AMINE UNII-1Y702GD0FG; View all

1.3 CAS No.: 6419-19-8

1.4 CID: 16698

1.5 EINECS(EC#): 229-146-5

1.6 Molecular Formula: C3H12NO9P3 (isomer)

1.7 Inchi: InChI=1S/C3H12NO9P3/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)

1.8 InChIkey: YDONNITUKPKTIG-UHFFFAOYSA-N

1.9 Canonical Smiles: C(N(CP(=O)(O)O)CP(=O)(O)O)P(=O)(O)O

1.10 Isomers Smiles: C(N(CP(=O)(O)O)CP(=O)(O)O)P(=O)(O)O

2. Properties

2.1 Density: 1.3g/mLat 25°C

2.1 Melting point: ~215°C (dec.)

2.1 Boiling point: 746.2ºC at 760 mmHg

2.1 Refractive index: 1.610

2.1 Flash Point: 405.1ºC

2.1 Precise Quality: 298.97200

2.1 PSA: 205.26000

2.1 logP: -1.30600

2.1 Solubility: 3.34 M

2.2 Appearance: Liquid; PelletsLargeCrystals

2.3 Chemical Properties: colourless liquid

2.4 PH: 0.46

2.5 pKa: 0.56±0.10(Predicted)

2.6 Water Solubility: 1000 mg/mL at 25 °C

2.7 Stability: Stable. Incompatible with bases, strong oxidizing agents.

3. Use and Manufacturing

3.1 Usage: It is used for power plants, refineries, petrochemicals, fertilizer plant cooling water, oil field injection water system,particularly suitable for hard high-calcium, low concentration multiple systems, such as power plants and high hardness high salinity, bad water quality conditions of the oil pipeline inhibitors,which may decrease the risk of corrosion and scaling of metal equipment and pipeline. In the textile printing and dyeing industry,Amino tris(methylene phosphonic acid) is used as a metal ion chelating agent, metal surface treatment agent.

4. Safety and Handling

4.1 Symbol: GHS07

4.1 Hazard Codes: C

4.1 Signal Word: Warning

4.1 Risk Statements: R34

4.1 Safety Statements: S26-S45-S36/37/39-S25

4.1 Packing Group: III

4.1 Hazard Class: 8

4.1 Hazard Declaration: H319

4.1 RIDADR: 3265

4.1 Caution Statement: P305 + P351 + P338

4.1 WGK Germany: 1

4.1 RTECS: SZ9860000

4.1 Safety: Hazard Codes:?Xi,?C
Risk Statements: 36-34
R36: Irritating to eyes?
R34: Causes burns
Safety Statements: 26-45-36/37/39-25
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice?
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible)?
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection
S25: Avoid contact with eyes
RIDADR: 3265
WGK Germany: 1
RTECS: SZ9860000
F: 3-9
HazardClass: 8
PackingGroup: III

4.2 Specification: ?Aminotrimethylene phosphonic acid ,its CAS NO. is 6419-19-8,the synonyms is (Nitrilotris(methylene))trisphosphonic acid ; 4-01-00-03070 (Beilstein Handbook Reference) ; AI3-51572 ; Amino, tris(methylene phosphonic acid) ; Aminotri(methylene phosphonic acid) ; Aminotri(methylenephosphonic acid) ; Aminotris(methanephosphonic acid) ; BRN 1715724 ; Dequest 2000 ; Dowell L 37 ; EINECS 229-146-5 ; Ferrofos 509 ; Nitrilotrimethylenephosphonic acid ; Nitrilotrimethylphosphonic acid ; Nitrilotris(methylphosphonic acid) ; Tris(phosphonomethyl)amine ; Phosphonic acid, (nitrilotris(methylene))tri- ; Phosphonic acid, P,P',P''-(nitrilotris(methylene))tris- .

4.3 Toxicity

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
duck	LD50	oral	> 2510mg/kg (2510mg/kg)	?	United States Environmental Protection Agency, Office of Pesticides and Toxic Substances. Vol. 8EHQ-0990-0937,
quail	LD50	oral	> 2510mg/kg (2510mg/kg)	?	United States Environmental Protection Agency, Office of Pesticides and Toxic Substances. Vol. 8EHQ-0990-0937,
rabbit	LD50	skin	> 6310mg/kg (6310mg/kg)	?	United States Environmental Protection Agency, Office of Pesticides and Toxic Substances. Vol. 8EHQ-0990-0937,
rat	LD50	oral	2100mg/kg (2100mg/kg)	?	Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 49(2), Pg. 67, 1984.

View all

5. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Corrosive to metals, Category 1

Skin irritation, Category 2

Eye irritation, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word	Warning
Hazard statement(s)	H290 May be corrosive to metals H315 Causes skin irritation H319 Causes serious eye irritation
Precautionary statement(s)
Prevention	P234 Keep only in original packaging. P264 Wash ... thoroughly after handling. P280 Wear protective gloves/protective clothing/eye protection/face protection.
Response	P390 Absorb spillage to prevent material damage. P302+P352 IF ON SKIN: Wash with plenty of water/... P321 Specific treatment (see ... on this label). P332+P313 If skin irritation occurs: Get medical advice/attention. P362+P364 Take off contaminated clothing and wash it before reuse. P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. P337+P313 If eye irritation persists: Get medical advice/attention.
Storage	P406 Store in a corrosion resistant/...container with a resistant inner liner.
Disposal	none

2.3 Other hazards which do not result in classification

none

View all

6. Synthesis Route

6419-19-8Total: 11 Synthesis Route

50-00-0 66 Suppliers

6419-19-8 416 Suppliers

Literatures:
STRAITMARK HOLDING AG; NOTTE, Patrick; PIRARD, Cedric, Nicolas; LEMIN, David Patent: WO2010/136573 A1, 2010 ; Location in patent: Page/Page column 18 ;
Yield: ~69%

50-00-0 66 Suppliers

6419-19-8 416 Suppliers

2617-47-2 10 Suppliers

Literatures:
Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation), , vol. 33, # 12 p. 2535 - 2540 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, , # 12 p. 2768 - 2773
Yield: null

50-00-0 66 Suppliers

6419-19-8 416 Suppliers

5995-25-5 2 Suppliers

Literatures:
EP2112156 A1, ; Page/Page column 10 ;
Yield: null

View all

7. Precursor and Product

precursor:

120060-75-5

3852-14-0

50-00-0

139-13-9

6806-71-9

product :

2617-47-2

15834-10-3

5995-25-5

1066-51-9

35869-68-2

17261-34-6

8. Other Information

8.0 Mesh Entry Terms: (nitrilotris(methylene))triphosphonic acid

8.1 Production: 10,000,000 - 50,000,000 lb

8.2 Manufacturing Info: All other basic organic chemical manufacturing|Phosphonic acid, P,P',P''-[nitrilotris(methylene)]tris-: ACTIVE

8.3 Use Classification: EPA Safer Chemical Functional Use Classes -> Oxidants and Oxidant Stabilizers|Safer Chemical Classes -> Yellow triangle - The chemical has met Safer Choice Criteria for its functional ingredient-class, but has some hazard profile issues|Cosmetics -> Chelating

9. Computational chemical data

Molecular Weight: 299.05000g/mol
Molecular Formula: C₃H₁₂NO₉P₃
Compound Is Canonicalized: True
XLogP3-AA: -7.2
Exact Mass: 298.97249195
Monoisotopic Mass: 298.97249195
Complexity: 305
Rotatable Bond Count: 6
Hydrogen Bond Donor Count: 6
Hydrogen Bond Acceptor Count: 10
Topological Polar Surface Area: 176
Heavy Atom Count: 16
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADccBCPAMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAFAgACCAAAAAAAAQAAAMAABAAQAAAAIAAAAAAAAAAAAAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

10. Question & Answer

What are the uses and applications of Amino tris(methylene phosphonic acid) (ATMP)? Feb 04 2023
Amino tris(methylene phosphonic acid), also known as ATMP, is a compound with excellent chelating, scale inhibition, and lattice distortion properties. It is synthesized in one step from ammonium chlo..
What is the background and overview of Amino tris(methylene phosphonic acid)? Apr 07 2020
Amino tris(methylene phosphonic acid) (ATMP) is a chemical compound with excellent stability and resistance to hydrolysis in water due to its C-P bond. It has a good corrosion inhibition effect when t..

11. Recommended Suppliers

Global395SuppliersView all >>

Wuhan Pharmchem Co., LTD. Diamond member

2YRS

Products:Pharma &Food Intermediates Water Treatment Chemicals Industrial Specialties Fine Chemicals
Tel:86-27-85835203
Email:steven@cspharmchem.com

Amino Trimethylene Phosphonic Acid, ATMP

Purity:99%Packing: 200kg/bag FOB
Price: 30 USD/kg
Time: 2023/10/03

Inquire

Hebei Chengcai Biotechnology Co., LTD Diamond member

1YR

Products:We are engaged in the development, marketing and sales of apis, intermediates, natural products (extracts), fine chemicals, food additives, agricultural chemicals and other products.
Tel:0086-0319-19131200228
Email:17610795226@chengcaibio.com

Aminotrimethylene phosphonic acid CAS 6419-19-8

Purity:99%Packing: 200kg/bag FOB
Price: 100 USD/kg
Time: 2023/10/03

Inquire

Hebei Crovell Biotech Co. Ltd Diamond member

3YRS

Products:Cosmetic Raw Materials,solvents,etc.
Tel:86-311-66562153
Email:breeduan@crovellbio.com

Amino Trimethylene Phosphonic Acid powder (ATMP) CAS 6419-19-8

Purity:99%Packing: 200kg/bag FOB
Price: 2.5 USD/kilogram
Time: 2023/09/28

Inquire

Xiamen wonderful Biotechnology Co., Ltd. Diamond member

1YR

Products:Top quality and high purity with safe transportation and low price
Tel:+86187-59294010-18759294010
Email:Beata@xmwonderfulbio.com

Aminotrimethylene phosphonic acid

Purity:99%Packing: 200kg/bag FOB
Price: 120 USD/g
Time: 2023/09/28

Inquire

Qiaoxi Shengyou Chemical Co., LTD Diamond member

1YR

Products:pharmaceutical intermediates Organic raw materialsAnimal and plant extracts1.4BDO, Eutylone,4MMC, JWH ,SGT Peptide, Steroids, Benzos,Dissociatives
Tel:86-311-18931626169
Email:accountmanager1@yeah.net

Amino Trimethylene Phosphoric Acid