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2-(1-Naphthyl)acetamid
Naphthaleneacetamide · NAAM · Frufix · Rootone · dirigoln · Rosetone · NAI-DPAC · NAA Amide
Identifikatoren & physikalische Daten
| CAS No. | 86-86-2 |
|---|---|
| Summenformel | C12H11NO |
| Durchschnittliche Molmasse | 185,22 g/mol |
| Monoisotopische Masse | 185,08406397 g/mol |
| SMILES | NC(=O)Cc1cccc2ccccc12 |
| InChIKey | XFNJVKMNNVCYEK-UHFFFAOYSA-N |
| PubChem CID | 6861 |
| ChEMBL | CHEMBL3186653 |
| ChEBI | CHEBI:81810 |
| EC No. | 201-704-2 |
| DTXSID | DTXSID3020914 |
| Lokaler Name | 2-(1-Naphthyl)acetamid |
Chemische & physikalische Eigenschaften
| XLogP | 2,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 43,1 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 14 |
| Formalladung | 0 |
| Komplexität | 214 |
| Löslichkeit | 0.039 mg/mL at 40 °CDMSO (Slightly), Methanol (Slightly) |
| Schmelzpunkt | 184 °C180-183 °C (lit.) |
| Physical Description | Solid |
| Siedepunkt | 319.45°C (rough estimate) |
| Dichte | 1.0936 (rough estimate) |
| Brechungsindex | 1.5300 (estimate) |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| pKa (Säurekonstante) | 16.10±0.40(Predicted) |
| Farbe | White to Off-White |
| BRN | 1945547 |
| Henry-Konstante | 9.8×107 mol/(m3Pa) at 25℃, Maniere et al. (2011) |
| Hauptanwendungen | agricultureenvironmental |
| InChI | 1S/C12H11NO/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,13,14) |
| InChIKey | XFNJVKMNNVCYEK-UHFFFAOYSA-N |
| SMILES | NC(=O)Cc1cccc2ccccc12 |
| CAS Datenbank | 86-86-2(CAS DataBase Reference) |
| NIST chemische Informationen | 1-Naphthaleneacetamide(86-86-2) |
| EPA chemische Informationen | 1-Naphthaleneacetamide (86-86-2) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (99.4%): Harmful if swallowed [Warning Acute toxicity, oral]H318 (27.8%): Causes serious eye damage [Danger Serious eye damage/eye irritation]H361d (64.8%): Suspected of damaging the unborn child [Warning Reproductive toxicity]H412 (67.3%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P203, P264, P264+P265, P270, P273, P280, P301+P317, P305+P354+P338, P317, P318, P330, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 162 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| Regulatorische Informationen | Commission Regulation (EC) No 33/20082008/941/EC, Reg. (EU) 2023/2592, Reg. (EU) No 2019/291, Reg. (EU) No 540/2011, Reg. (EU) No 786/20111-Naphthalenacetamide: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
| Hazard Classes and Categories | Acute Tox. 4 (99.4%)Eye Dam. 1 (27.8%)Repr. 2 (64.8%)Aquatic Chronic 3 (67.3%) |
| Protective Action Criteria (PAC) | 5.1 [mg/m3]56 [mg/m3]330 [mg/m3] |
| RAIS Toxicity Values | 0.25OPP |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 29242990 |
| RTECS-Nr. | QJ0590000 |
| R-Sätze (R) | 22-41-34-11 |
| Gefahrensymbole | Xn,C,F |
| Sicherheitshinweise (S) | 26-39-24/25-45-36/37/39-16 |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Acute Tox. 4 OralAquatic Chronic 3Eye Dam. 1Repr. 2 |
Anwendungen & Verwendung
Verwenden
1-Naphthylacetamide (cas# 86-86-2) is a compound useful in organic synthesis.