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Documenti fondamentali

O111

Sigma-Aldrich

Octoclothepin maleate salt

solid

Sinonimo/i:

1-(8-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-4-methyl-piperazine maleate salt

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About This Item

Formula empirica (notazione di Hill):
C19H21ClN2S · C4H4O4
Numero CAS:
Peso molecolare:
460.97
Numero MDL:
Codice UNSPSC:
12352200
ID PubChem:
NACRES:
NA.77

Stato

solid

Colore

white

Solubilità

45% (w/v) aq 2-hydroxypropyl-β-cyclodextrin: >21 mg/mL

Stringa SMILE

[H]\C(=C(/[H])C(O)=O)C(O)=O.CN1CCN(CC1)C2Cc3ccccc3Sc4ccc(Cl)cc24

InChI

1S/C19H21ClN2S.C4H4O4/c1-21-8-10-22(11-9-21)17-12-14-4-2-3-5-18(14)23-19-7-6-15(20)13-16(17)19;5-3(6)1-2-4(7)8/h2-7,13,17H,8-12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
GWKBZIADWSOIQV-BTJKTKAUSA-N

Informazioni sul gene

Azioni biochim/fisiol

D2 dopamine receptor antagonist; 5-HT2 serotonin receptor antagonist.

Pittogrammi

Skull and crossbones

Avvertenze

Danger

Indicazioni di pericolo

Consigli di prudenza

Classi di pericolo

Acute Tox. 3 Oral

Codice della classe di stoccaggio

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

Classe di pericolosità dell'acqua (WGK)

WGK 3

Punto d’infiammabilità (°F)

Not applicable

Punto d’infiammabilità (°C)

Not applicable

Dispositivi di protezione individuale

Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges


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Octoclothepin (1) was resolved into its R and S enantiomers via the diastereomeric tartaric acid salts. The enantiomers were shown to be of high optical purity by 1H NMR with use of the chiral shift reagent (R)-(-)-2,2,2-trifluoro-1-(9-anthryl)ethanol. Pharmacological and biochemical
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