Diethyl-(hydroxymethyl)phosphonat
Diethyl phosphonomethanol
Daten werden ergänzt – lade die Seite später neu, um den aktuellen Stand zu sehen
Grundinformationen
- CAS
3084-40-0- Standard-SMILES
CCOP(=O)(CO)OCC- InChIKey
RWIGWWBLTJLKMK-UHFFFAOYSA-N- Summenformel
- C5H13O4P
- Durchschnittliche Molmasse
- 168,13 g/mol
- Monoisotopische Masse
- 168,05514553
Namen und Bezeichner
- Bevorzugter Name
- Diethyl phosphonomethanol
- IUPAC
- diethoxyphosphorylmethanol
- Lokaler Name
- Diethyl-(hydroxymethyl)phosphonat
- Englischer Name
- Diethyl (hydroxymethyl)phosphonate
- Summenformel
- C5H13O4P
- Molmasse
- 168.13
Namen und Synonyme
Diethyl (hydroxymethyl)phosphonate3084-40-0diethoxyphosphorylmethanolDiethyl phosphonomethanolPhosphonic acid, (hydroxymethyl)-, diethyl ester(Hydroxymethyl)phosphonic acid, diethyl esterPhosphonic acid, P-(hydroxymethyl)-, diethyl esterNR74SN9XT3EINECS 221-391-6DTXSID6062838diethyl P-(hydroxymethyl)phosphonateRefChem:587276
Weitere Namen anzeigen
midbodyAURORA KA-1421intermediateobjectDIETHYL HYDROXYMETHYLTenofovir Impurity 83Diethyl PhosphonometanolDiethyl hydroxymethyl phosphate
DTXCID9038268221-391-6Diethyl hydroxymethylphosphonateDiethyl(hydroxymethyl)phosphonate(Hydroxymethyl)phosphonic Acid Diethyl EsterC5H13O4PMFCD00014418Tenofovir Impurity 62
Datenbank-Bezeichner
- CAS
3084-40-0- PubChem CID
- 76513
- DTXSID
DTXSID6062838- UNII
- NR74SN9XT3
- EC Number
- 221-391-6
- Nikkaji
- J217.247J
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- -0,4
- Polarare Oberfläche (TPSA)
- 55,8 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 5
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 115
Experimentelle und physikochemische Eigenschaften
Physical DescriptionLiquid
Physikochemische Eigenschaften
- Siedepunkt
- 124 · 124-126 °C/3 mmHg (lit.)
- Dichte
- 1.14 g/mL · 1.14 g/mL at 25 °C (lit.)
- Brechungsindex
- 20 · n20/D 1.444(lit.)
- Flammpunkt
- 230 °F · >230 °F
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Aggregatzustand
- Viscous Liquid
- pka
- 13 · 13.00±0.10(Predicted)
- Farbe
- Clear colorless to yellow
- Wasserlöslichkeit
- 500 g/L · 500g/L at 20℃
- InChI
- InChI=1S/C5H13O4P/c1-3-8-10(7,5-6)9-4-2/h6H,3-5H2,1-2H3
- InChIKey
- RWIGWWBLTJLKMK-UHFFFAOYSA-N
- SMILES
- P(CO)(=O)(OCC)OCC
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 82.7% (43 of 52) of all reports.
Warning
H315 (15.4%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 52 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Phosphonic acid, P-(hydroxymethyl)-, diethyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phosphonic acid, P-(hydroxymethyl)-, diethyl ester 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: 27-07-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/32469
Hazard Classes and CategoriesSkin Irrit. 2 (15.4%)
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29319090
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 37/39-26-36-37
- Speicherklasse
- 12 - Non Combustible Liquids
Chemie und Industrie
Verwendung und Herstellung
U.S. Production2023: 50,000 - <250,000 lb
Industry UsesFlame retardant
General Manufacturing Information
Asphalt Paving, Roofing, and Coating Materials Manufacturing
Phosphonic acid, P-(hydroxymethyl)-, diethyl ester: ACTIVE
Anwendungen
VerwendenDiethyl hydroxymethylphosphonate acts as a reactant for synthesis of α And β-dialkoxyphosphoryl isothiocyanate used in antiproliferative studies, dendritic polyglycerol anions for L-selectin inhibition, phosphonates for anti-HIV-1 activity, homo and copolymers of phosphonated norbornenes, Mitsunobu reactions. It is involved in studies of FBPase inhibition by phosphonic acid-containing thaizoles.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Zugehörige Reaktionen
77
Notizen zur Verbindung
Wird geladen…