HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Nikethamid
NIKETHAMIDE · Nikotin · Niketamide · CORVOTONE · Tonocard · nicor · Ni-Cor · Corivo
Identifikatoren & physikalische Daten
| CAS No. | 59-26-7 |
|---|---|
| Summenformel | C10H14N2O |
| Durchschnittliche Molmasse | 178,23 g/mol |
| Monoisotopische Masse | 178,11061307 g/mol |
| SMILES | CCN(CC)C(=O)c1cccnc1 |
| InChIKey | NCYVXEGFNDZQCU-UHFFFAOYSA-N |
| PubChem CID | 5497 |
| ChEMBL | CHEMBL2104607 |
| ChEBI | CHEBI:134814 |
| EC No. | 200-418-5 |
| DTXSID | DTXSID9046524 |
| Lokaler Name | Nikethamid |
Chemische & physikalische Eigenschaften
| XLogP | 0,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 33,2 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 13 |
| Formalladung | 0 |
| Komplexität | 166 |
| Arzneimittel | DEA NFLIS-Drug Category -> StimulantsPharmaceuticals -> Used in Switzerland |
| SpringerMaterials Properties | Chemical shift |
| Dichte | 1.058 to 1.066 at 77 °F (NTP, 1992)1.06 g/mL at 25 °C (lit.) |
| Löslichkeit | greater than or equal to 100 mg/mL at 73 °F (NTP, 1992)Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly) |
| Flammpunkt | 235 °F (NTP, 1992)>230 °F |
| Human Drugs | Pharmaceuticals |
| Siedepunkt | 565 to 572 °F at 760 mmHg (some decomposition) (NTP, 1992)296-300 °C (lit.) |
| Schmelzpunkt | 75 to 79 °F (NTP, 1992)23 °C (lit.) |
| Physical Description | Nicethamid appears as clear light yellow viscous liquid or crystalline solid. Slightly bitter taste followed by a faint sensation of the warmth. (NTP, 1992) |
| Ionization Efficiency | Positive4.462.7Agilent XCTElectrospray ionizationformic acid (5.3nM) |
| Brechungsindex | n20/D 1.524(lit.) |
| Lagerbedingungen | 2-8°C |
| pKa (Säurekonstante) | pKa 3.46(H2O,t =20) (Uncertain) |
| Aggregatzustand | Liquid |
| Farbe | Clear colorless to yellow |
| Merck | 14,6543 |
| BRN | 5743 |
| InChI | InChI=1S/C10H14N2O/c1-3-12(4-2)10(13)9-6-5-7-11-8-9/h5-8H,3-4H2,1-2H3 |
| InChIKey | NCYVXEGFNDZQCU-UHFFFAOYSA-N |
| SMILES | C1=NC=CC=C1C(N(CC)CC)=O |
| CAS Datenbank | 59-26-7(CAS DataBase Reference) |
| EPA chemische Informationen | Nikethamide (59-26-7) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 85 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Status: Active Update: 02-10-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/196763-Pyridinecarboxamide, N,N-diethyl-: Does not have an individual approval but may be used under an appropriate group standard |
| DOT-Kennzeichnung | Poison |
| Brandgefahren | This chemical is combustible. (NTP, 1992) |
| Gesundheitsgefahren | ACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits toxic fumes. (NTP, 1992) |
| Reaktive Gruppe | Amides and Imides |
| Reactivity Profile | NICETHAMID is incompatible with sodium carbonate solutions which cause precipitation. (NTP, 1992). |
| Air and Water Reactions | Water soluble. |
| Hazard Classes and Categories | Acute Tox. 3 (100%) |
| Brandbekämpfung | Fires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992) |
| Erste Hilfe | EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop. |
| Freisetung ohne Brand | SMALL SPILLS AND LEAKAGE: If you should spill this chemical, use absorbent paper to pick up all liquid spill material. Seal the absorbent paper, as well as any of your clothing which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Wash any surfaces you may have contaminated with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned. |
Anwendungen & Verwendung
Beschreibung
A further Corydalis alkaloid, coramine has been obtained from C. pseudoadunca M. Pop. It forms colourless needles from EtOH and is optically active with a specific rotation of [α]D - 391 ° (c 0.2, MeOH). Both the hydrochloride, m.p. 216-9°C and the hydrobromide, m.p. 223-6°C have been described.
Verwenden
analeptic