Grundinformationen
- Standard-SMILES
Cl.O=C(C1COc2ccccc2O1)N1CCNCC1- InChIKey
TUKBWYXLYINULI-UHFFFAOYSA-N- Summenformel
- C13H17ClN2O3
- Durchschnittliche Molmasse
- 284,74 g/mol
- Monoisotopische Masse
- 284,09277008
Namen und Bezeichner
- Bevorzugter Name
- 1-(1,4-Benzodioxan-2-ylcarbonyl)piperazine hydrochloride
- IUPAC
- 2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-1-yl)methanone;hydrochloride
Namen und Synonyme
EC 415-660-91-(1,4-benzodioxan-2-ylcarbonyl)piperazine hydrochlorideMethanone, (2,3-dihydro-1,4-benzodioxin-2-yl)-1-piperazinyl-, hydrochloride (1:1)RefChem:419430415-660-970918-74-01-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazine hydrochloride2-(1-Piperazinylcarbonyl)-1,4-benzodioxane HydrochlorideN-(1,4-Benzodioxan-2-Carbonyl)Piperazine HydrochlorideMFCD00729051(2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)(piperazin-1-yl)methanone hydrochlorideDoxazosin Related Compound A
Weitere Namen anzeigen
n-(1,4-benzodioxan-2-carbonyl)-piperazine hydrochlorideDoxazosin EP Impurity B2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-1-yl)methanone;hydrochloride(2,3-DIHYDRO-BENZO[1,4]DIOXIN-2-YL)-PIPERAZIN-1-YL-METHANONE HCLn-(1,4-benzodioxan-2-carbonyl)piperazinehydrochloride(2,3-Dihydrobenzo[1,4]dioxin-2-yl)piperazin-1-yl-methanone hydrochloride1-[(2,3-Dihydro-1,4-benzodioxin-2-yl)carbonyl]piperazine Monohydrochloride2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-4-ium-1-yl)methanone;chloride
Datenbank-Bezeichner
- CAS
70918-74-0- PubChem CID
- 2822434
- DTXSID
DTXSID00384918- UNII
- SK3FQQ8W9N
- EC Number
- 415-660-9、673-692-0
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 50,8 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 19
- Formalladung
- 0
- Komplexität
- 305
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H301: Toxic if swallowed [Danger Acute toxicity, oral]
P260, P261, P262, P264, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P316, P319, P321, P330, P361+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Danger
H301+H311+H331 (97.4%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
P260, P261, P262, P264, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P316, P319, P321, P330, P361+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Gefahrenhinweise
Regulatory InformationREACH registered substance: 1-(1,4-benzodioxan-2-ylcarbonyl)piperazine hydrochloride (EC: 415-660-9)
Hazard Classes and Categories
Acute Tox. 3 (100%)
Acute Tox. 3 (97.4%)
Acute toxicity - category 3
Acute Tox. 3 *
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