CAS 51805-45-9 Tris(2-carboxyethyl)phosphine hydrochloride (HCID 2734570)

Namen und Bezeichner

Bevorzugter Name: Tris(2-carboxyethyl)phosphine hydrochloride
IUPAC: 3-[bis(2-carboxyethyl)phosphanyl]propanoic acid;hydrochloride
Englischer Name: Tris(2-carboxyethyl)phosphine hydrochloride
Summenformel: C9H15O6P.ClH
Molmasse: 286.65

Namen und Synonyme

51805-45-9Tris(2-carboxyethyl)phosphine hydrochlorideTCEP HydrochlorideTCEP HClTcep hydrochloride [MI]UNII-H49AAM893KH49AAM893KDTXSID10370367Propanoic acid, 3,3',3''-phosphinylidynetris-, hydrochloride (1:1)RefChem:192079DTXCID80321402629-759-1

Weitere Namen anzeigen

TRI(2-CARBOXYETHYL)PHOSPHINE HYDROCHLORIDETCEP-HCITCEP SolutionTCEP, HYDROCHLORIDETris(2-carboxyethyl)phosphine hydrochloride, 98% 1GRTCEP*HCL0.5M TCEP500 MM TCEP

3,3',3''-Phosphinetriyltripropanoic acid hydrochlorideMFCD00145469TCEP (hydrochloride)3-[bis(2-carboxyethyl)phosphanyl]propanoic acid;hydrochlorideC9H16ClO6PTris(carboxyethyl)phosphine hydrochloridetris-(2-carboxyethyl)phosphine hydrochloride3-[bis(2-carboxyethyl)phosphanyl]propanoic acid hydrochloride

Datenbank-Bezeichner

CAS: 51805-45-9
PubChem CID: 2734570
DTXSID: DTXSID10370367
ChEMBL: CHEMBL2047686
UNII: H49AAM893K
EC Number: 629-759-1

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 112 Å²
H-Brücken-Donoren: 4
H-Brücken-Akzeptoren: 6
Frei drehbare Bindungen: 9
Schwere Atome: 17
Formalladung: 0
Komplexität: 222

Physikochemische Eigenschaften

Schmelzpunkt: 177 °C · 177 °C
Dichte: 1.041 g/mL · 1.041 g/mL at 25 °C
Brechungsindex: 20 · n20/D 1.367
storage temp.: 2 · 2-8°C
Löslichkeit: 2 O: · H2O: 50 mg/mL
Aggregatzustand: powder
pka: 7.66 · 7.66(at 25℃)
Farbe: white
PH: 7 · 7.0(aqueous solution; pH was adjusted with ammonium hydroxide)
Wasserlöslichkeit: Soluble in water and methanol.
Merck: 14 · 14,9085
BRN: 3724376 · 3724376
Stabilität: 1 year · Stable for 1 year from date of purchase as supplied. Solutions in distilled water may be stored at -20°C for up to 1 month.
InChI: 1S/C9H15O6P.ClH/c10-7(11)1-4-16(5-2-8(12)13)6-3-9(14)15;/h1-6H2,(H,10,11)(H,12,13)(H,14,15);1H
InChIKey: PBVAJRFEEOIAGW-UHFFFAOYSA-N
SMILES: Cl[H].OC(=O)CCP(CCC(O)=O)CCC(O)=O
CAS Datenbank: 51805 · 51805-45-9(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H314 (98.2%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (15.9%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 226 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Corr. 1A (98.2%)；Eye Dam. 1 (15.9%)

Sicherheitsdaten

F: 10
wgk: 2
tsca: No
ridadr: UN 3261 8/PG 2
hs_code: 29319090
risk_code: 36/38-36/37/38-34
hazard_code: C,Xi
safety_code: 26-37/39-36/37/39-27-45
hazard_class: 8
packing_group: III
Speicherklasse: 8A - Combustible corrosive hazardous materials
Hazard Classifications: Eye Dam. 1Skin Corr. 1B

Chemie und Industrie

Anwendungen

VerwendenTCEP (Tris(2-carboxyethyl)phosphine hydrochloride) is an alternative which is not pungent, more stable and works even at low pH. It is more selective, i.e. do not reduce metals and buried disulfides.

Darstellung · 1 Eintrag

synthetischeThe preparation of Tris(2-carboxyethyl)phosphine hydrochloride is as follows:Trimethyl 3,3 ', 3 "-phosphine triphenylpropionate (92.5g, 0.28mol) prepared as described above was added to a 250 ml reaction flask under mechanical stirring conditions and a molar ratio of 12mol/(120ml, 1.44mol), the mixture was heated to 90°C, the solid gradually dissolved, continue to heat the reaction 4h, stirring and cooling with ice water, precipitation of white solid, filter, filter cake with distilled water to get white (2-carboxyethyl) phosphine hydrochloride, dried, weighing 61.3g, yield 82.4%