HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Nitrilotrimethylentris(phosphonsure)
ATMP · AMINO TRIMETHYLENE PHOSPHONIC ACID (ATMP) · ATMPA · ntpo · Dequest 2000 · NitriL · TRIS(PHOSPHONOMETHYL)AMINE · NITRILOTRIMETHANEPHOSPHONIC ACID
Identifikatoren & physikalische Daten
| CAS No. | 20592-85-2 |
|---|---|
| Summenformel | C3H12NO9P3 |
| Durchschnittliche Molmasse | 299,05 g/mol |
| Monoisotopische Masse | 298,97249085 g/mol |
| SMILES | O=P(O)(O)CN(CP(=O)(O)O)CP(=O)(O)O |
| InChIKey | YDONNITUKPKTIG-UHFFFAOYSA-N |
| PubChem CID | 16698 |
| ChEMBL | CHEMBL260191 |
| ChEBI | CHEBI:168957 |
| EC No. | 229-146-5 |
| DTXSID | DTXSID2027624 |
| Lokaler Name | Nitrilotrimethylentris(phosphonsure) |
Chemische & physikalische Eigenschaften
| XLogP | -7,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 176 |
| H-Brücken-Donoren | 6 |
| H-Brücken-Akzeptoren | 10 |
| Frei drehbare Bindungen | 6 |
| Schwere Atome | 16 |
| Formalladung | 0 |
| Komplexität | 305 |
| Stoffklassen | Other Classes -> Phosphate Compounds |
| Kosmetika | Chelating |
| SpringerMaterials Properties | Crystal structure |
| LogP (Verteilungskoeffizient) | -3.53 |
| Dichte | 1.33 @ 20°C1.3 g/mL at 25 °C |
| Löslichkeit | 1000 mg/mL at 25 °CWater (Slightly, Heated)500g/L at 20℃ |
| Siedepunkt | 105 °C @760 [mm Hg]746.2±70.0 °C(Predicted) |
| Schmelzpunkt | 210 - 215 °C-14 °C~215 °C (dec.) |
| Dampfdruck | 0.0000001 [mmHg]0Pa at 25℃ |
| Food Contact Substances | FCS -> FDA Cumulative Estimated Daily Intake (CEDI) |
| Physical Description | LiquidCBIGlassy solid[CHEMINFO] Fine white crystals[MSDSonline] |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Aggregatzustand | Solid |
| pKa (Säurekonstante) | 0.56±0.10(Predicted) |
| Farbe | White |
| pH | 0.46 |
| BRN | 1715724 |
| Stabilität | Stable. Incompatible with bases, strong oxidizing agents. |
| Kosmetik-Inhaltsstoffe Funktionen | CHELATING |
| 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) |
| InChIKey | YDONNITUKPKTIG-UHFFFAOYSA-N |
| SMILES | OP(O)(=O)CN(CP(O)(O)=O)CP(O)(O)=O |
| LogP (Verteilungskoeffizient) | -3.5 |
| CAS Datenbank | 6419-19-8(CAS DataBase Reference) |
| EPA chemische Informationen | Aminotri(methylene phosphonic acid) (6419-19-8) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 8.2% (66 of 802) of reports.WarningH290 (48.4%): May be corrosive to metals [Warning Corrosive to Metals]P234, P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P390, and P406 (click each P-code to see the statement)Aggregated GHS information provided per 802 reports by companies from 29 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.This chemical does not meet GHS hazard criteria for 96.5% (305 of 316) of all reports. |
|---|---|
| Regulatorische Informationen | Chemical: Phosphonic acid, P,Pâ²,Pâ²â²-[nitrilotris(methylene)]tris-Phosphonic acid, P,P',P''-[nitrilotris(methylene)]tris-, sodium salt (1:?) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phosphonic acid, P,P',P''-[nitrilotris(methylene)]tris-, sodium salt (1:?) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Phosphonic acid, P,P',P''-[nitrilotris(methylene)]tris- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phosphonic acid, P,P',P''-[nitrilotris(methylene)]tris- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Status: Active Update: 24-02-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/15198Status: Active Update: 18-04-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/14507Aminotri(methylenephosphonic acid): Does not have an individual approval but may be used under an appropriate group standard |
| Weitere Sicherheitsinformationen | IMAP assessments - Phosphonic acid, [nitrilotris(methylene)]tris-: Human health tier I assessment |
| Gefahrenübersicht | An eye irritant[MSDSonline] No adverse effects reported in workers except irritation in >20 years of use[AIHA] |
| EPA Safer Chemical | Chemical: Aminotrimethylene phosphonic acid |
| Hazard Classes and Categories | Not ClassifiedMet. Corr. 1 (48.4%) |
| Protective Action Criteria (PAC) | 30 [mg/m3]69 [mg/m3]420 [mg/m3] |
| F | 3-9 |
| Wassergefährdungsklasse (WGK) | 1 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | 3265 |
| Zollcode | 29319090 |
| RTECS-Nr. | SZ9860000 |
| R-Sätze (R) | 36-34-35 |
| Gefahrensymbole | Xi,C |
| Sicherheitshinweise (S) | 26-45-36/37/39-25-44-36 |
| Gefahrenklasse | 8Met. Corr. 1 |
| Verpackungsgruppe | III |
| Lagerklasse | 8A - Combustible corrosive hazardous materials |
Anwendungen & Verwendung
Verwenden
A powerful complexing agent. A potent acid sphingomyelinase inhibitor.