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Benzo[c]phenanthren
Tetrahelicene · 3,4-Benzphenanthrene · Benzo(c)phenanthrene · 3,4-Benzophenanthrene · Zavegepant Impurity 6 · Benzo-3,4-phenanthrene · 3,4-Benzo[c]phenthrene · 3,4-Benzo[c]phenanthrene
![Molekülstruktur von Benzo[c]phenanthren](/img/chemical/9136.png)
Identifikatoren & physikalische Daten
| CAS No. | 195-19-7 |
|---|---|
| Summenformel | C18H12 |
| Durchschnittliche Molmasse | 228,3 g/mol |
| Monoisotopische Masse | 228,09390038 g/mol |
| SMILES | c1ccc2c(c1)ccc1ccc3ccccc3c12 |
| InChIKey | TUAHORSUHVUKBD-UHFFFAOYSA-N |
| PubChem CID | 9136 |
| ChEBI | CHEBI:82292 |
| EC No. | 205-896-9 |
| DTXSID | DTXSID4075459 |
| Lokaler Name | Benzo[c]phenanthren |
Chemische & physikalische Eigenschaften
| XLogP | 5,7 |
|---|---|
| Polarare Oberfläche (TPSA) | 0 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 0 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 18 |
| Formalladung | 0 |
| Komplexität | 266 |
| Polymers | Other Classes -> Polycyclic Aromatic Hydrocarbons |
| SpringerMaterials Properties | 13C nuclear magnetic resonance spectrum |
| Dampfdruck | 0.00000067 [mmHg] |
| Physical Description | Solid[Merck Index] |
| Schmelzpunkt | 158-160℃ |
| Siedepunkt | 305.1°C (rough estimate) |
| Dichte | 1.1209 (estimate) |
| Brechungsindex | 1.5500 (estimate) |
| Lagerbedingungen | Sealed in dry,2-8°C |
| Löslichkeit | Acetonitrile (Slightly), Chloroform (Slightly) |
| Farbe | Needles from EtOH or pet ether |
| BRN | 1909296 |
| Stabilität | Light Sensitive |
| InChI | InChI=1S/C18H12/c1-3-7-16-13(5-1)9-11-15-12-10-14-6-2-4-8-17(14)18(15)16/h1-12H |
| InChIKey | TUAHORSUHVUKBD-UHFFFAOYSA-N |
| SMILES | C1=C2C(C3C(C=C2)=CC=CC=3)=C2C=CC=CC2=C1 |
| EPA chemische Informationen | Benzo[c]phenanthrene (195-19-7) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (76.4%): Harmful if swallowed [Warning Acute toxicity, oral]P203, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P318, 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 55 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.H351: Suspected of causing cancer [Warning Carcinogenicity] |
|---|---|
| Regulatorische Informationen | Hazard Traits - Carcinogenicity |
| Gefahrenübersicht | A skin and strong eye irritantHarmful by ingestion, inhalation, and skin absorptionPossible carcinogen[Sigma-Aldrich MSDS] See POLYCYCLIC AROMATIC HYDROCARBONS. |
| Hazard Classes and Categories | Acute Tox. 4 (76.4%)Carcinogenicity - Category 2 |
| Unerwünschte Wirkungen | IARC Carcinogen - Class 3: Chemicals are not classifiable by the International Agency for Research on Cancer. |
| Carcinogen Classification | Benzo[c]phenanthreneGroup 2B: Possibly carcinogenic to humansVolume 92: (2010) Some Non-heterocyclic Polycyclic Aromatic Hydrocarbons and Some Related Exposures2005NB Overall evaluation upgraded to Group 2B with supporting evidence from other relevant data |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | 2811 |
| RTECS-Nr. | DI8225000 |
| R-Sätze (R) | 20/21/22-36/37/38 |
| Toxizität | mma-sat 25 nmol/plate CNREA8 40,2876,80 |
| Gefahrensymbole | Xn |
| Sicherheitshinweise (S) |
Anwendungen & Verwendung
Verwenden
Benzo(c)phenanthrene is a PAH metabolite having a toxic effect on fish bone metabolite. Also, it is used as a marker of the carcinogenic potency of the polycyclic aromatic hydrocarbons (PAH) mixture. A genotoxic agent.