1-(3-chlorophenyl)-2-[[1,1-di(methyl-d3)ethyl-2,2,2-d3]amino]-1-propanone-3,3,3-d3 monohydrochloride
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Grundinformationen
- CAS
1189725-26-5- Standard-SMILES
Cl.[2H]C([2H])([2H])C(NC(C)C(=O)c1cccc(Cl)c1)(C([2H])([2H])[2H])C([2H])([2H])[2H]- InChIKey
HEYVINCGKDONRU-WWMMTMLWSA-N- Summenformel
- C13H19Cl2NO
- Durchschnittliche Molmasse
- 285,2619 g/mol
- Monoisotopische Masse
- 284,1408603
Namen und Bezeichner
- Bevorzugter Name
- 1-(3-chlorophenyl)-2-[[1,1-di(methyl-d3)ethyl-2,2,2-d3]amino]-1-propanone-3,3,3-d3 monohydrochloride
- IUPAC
- 1-(3-Chlorophenyl)-2-{[2-(~2~H_3_)methyl(~2~H_6_)propan-2-yl]amino}propan-1-one--hydrogen chloride (1/1)
- Englischer Name
- Bupropion-d9 hydrochloride
- Summenformel
- C13H9ClD9NO.ClH
- Molmasse
- 285.26
Namen und Synonyme
Zyban-d9Budeprion-d9Wellbutrin-d9Avibactam Impurity 88Bupropion Impurity 5 HClElontril-d9 HydrochlorideAplenzin-d9 HydrochlorideD9-Bupropion hydrochlorideBupropion-d9 hydrochlorideAMfebutaMon-d9 Hydrochloride
Datenbank-Bezeichner
- CAS
1189725-26-5- PubChem CID
- 45038477
- DTXSID
DTXSID60661833- EC Number
- 802-605-2
Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 233 · 233-234°C
- Flammpunkt
- 9 ℃ · 9℃
- storage temp.
- -20 °C · -20°C Freezer
- Löslichkeit
- DMSO (Slightly), Methanol (Slightly), Water (Slightly)
- Aggregatzustand
- Solid
- Farbe
- White to Off-White
- Major Application
- clinical testing
- InChI
- 1S/C13H18ClNO.ClH/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10;/h5-9,15H,1-4H3;1H/i2D3,3D3,4D3;
- InChIKey
- HEYVINCGKDONRU-WWMMTMLWSA-N
- SMILES
- CC(NC(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])C(C1=CC=CC(Cl)=C1)=O.Cl
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
Sicherheitsdaten
- wgk
- 1
- ridadr
- UN1230 - class 3 - PG 2 - Methanol, solution
- risk_code
- 11-23/24/25-39/23/24/25
- hazard_code
- F,T
- safety_code
- 7-16-36/37-45
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 3 OralFlam. Liq. 2STOT SE 1
Chemie und Industrie
Anwendungen
BeschreibungBupropion-d9 (hydrochloride) (CRM) (Item No. 22487) is a certified reference material intended for use as an internal standard for the quantification of bupropion by GC- or LC-MS. Bupropion is categorized as an antidepressant. It is also useful in promoting smoking cessation. This product is intended for research and forensic applications.
Verwenden(Bupropion D9 Hydrochloride) The isotopically labelled Bupropion, a selective inhibitor of dopamine uptake. Bupropion is an antidepressant of the aminoketone class; aid in smoking cessation
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