Methanone, (2,4-difluorophenyl)-4-piperidinyl-, oxime, hydrochloride (1:1)

HCID 57357481CAS 135634-18-3

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Grundinformationen

Standard-SMILES: Cl.ON=C(c1ccc(F)cc1F)C1CCNCC1
InChIKey: CPVWKXXFKMUDPA-UHFFFAOYSA-N
Summenformel: C12H15ClF2N2O
Durchschnittliche Molmasse: 276,71 g/mol
Monoisotopische Masse: 276,08409722

Namen und Bezeichner

Bevorzugter Name: Methanone, (2,4-difluorophenyl)-4-piperidinyl-, oxime, hydrochloride (1:1)
IUPAC: N-[(2,4-difluorophenyl)-piperidin-4-ylmethylidene]hydroxylamine;hydrochloride
Englischer Name: 2,4-Difluorophenyl-(4-piperidinyl)methanone oxime hydrochloride
Summenformel: C12H14F2N2O.ClH
Molmasse: 276.71

Namen und Synonyme

135634-18-3Methanone, (2,4-difluorophenyl)-4-piperidinyl-, oxime, hydrochloride (1:1)RefChem:10891102,4-Difluorophenyl-(4-piperidinyl)methanone oxime hydrochloride(2,4-Difluorophenyl)(piperidin-4-yl)methanone oxime hydrochloride(2,4-difluorophenyl)-(4-piperidyl)methanone oxime;hydrochloride((2,4-Difluorophenyl)(piperidin-4-yl)methanone oxime hydrochlorideSCHEMBL1833472DTXSID90723695CPVWKXXFKMUDPA-UHFFFAOYSA-NN-[(2,4-difluorophenyl)-piperidin-4-ylmethylidene]hydroxylamine;hydrochlorideSB43108

Weitere Namen anzeigen

NH26248Paliperidone Impurity 30Paliperidone Impurity 15 HClPaliperidone Impurity 12 HClPaliperidone Impurity 105 HCl(2, 4-dp)-piperidin-4-yl-methanone oximehcl(2,4-DIFLUOROPHENYL)(PIPERIDIN-4-YL)METHANONE OXIME HCL(2,4-difluorophenyl) (piperidin-4-yl) methanone oxime HCI4-Difluorophenyl-(4-piperidinyl)methanone oxime hydrochloride(2,4-Difluorophenyl)-4-piperidylMethanone OxiMe Hydrochloride

DB-063089ZZ4X-111126aliperidone Impurity 105 HCl4-(2,4-difluorobenzoyl)piperidine oxime hydrochloride4-(2,4-difluoro-benzoyl)-piperidine-oxime-hydrochloride4-(2,4-difluoro-benzoyl)piperidine-oxime hydrochloride2,4-difluorophenyl(4-piperidinyl)methanone oxime hydrochloride2,4-difluorophenyl-(4-piperidinyl)-methanone oxime hydrochlorideN-[(2,4-Difluorophenyl)(piperidin-4-yl)methylidene]hydroxylamine--hydrogen chloride (1/1)

Datenbank-Bezeichner

CAS: 135634-18-3
PubChem CID: 57357481
DTXSID: DTXSID90723695
EC Number: 603-927-4

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 44,6 Å²
H-Brücken-Donoren: 3
H-Brücken-Akzeptoren: 5
Frei drehbare Bindungen: 2
Schwere Atome: 18
Formalladung: 0
Komplexität: 280

Physikochemische Eigenschaften

storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
Aggregatzustand: powder to crystal
Farbe: White to Almost white

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 54 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Sicherheitsdaten

hs_code: 2933.39.9200

Chemie und Industrie

Anwendungen

VerwendenNH26248 is used in preparation of Iloperidone. Also, used in preparation of Amine derivatives as Potassium channel blockers useful in treatment and prevention of autoimmune and inflammatory diseases.