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HCID 11733Erstellt: 27. Oktober 2026
1,1,2-Trichlorpropan
Trichloropropanetech · 1,1,2-trichloro-propan · 1,1,2-Trichloropropane · Propane,1,1,2-trichloro- · Propane, 1,1,2-trichloro- · 1,1,2-Trichloropropane >2-CHLOROPROPYLIDENE CHLORIDE · (R,S)-1,1,2-trichloropropane · (R,S)-1,1,2-trichloro-propane
https://huagongshe.com/de/chemical/11733
Identifikatoren & physikalische Daten
| CAS No. | 598-77-6 |
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| Summenformel | C3H5Cl3 |
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| Durchschnittliche Molmasse | 147,43 g/mol |
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| Monoisotopische Masse | 145,945683 g/mol |
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| SMILES | CC(Cl)C(Cl)Cl |
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| InChIKey | GRSQYISVQKPZCW-UHFFFAOYSA-N |
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| PubChem CID | 11733 |
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| ChEMBL | CHEMBL3183042 |
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| EC No. | 209-951-8 |
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| DTXSID | DTXSID3024362 |
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| Lokaler Name | 1,1,2-Trichlorpropan |
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Chemische & physikalische Eigenschaften
| XLogP | 2,6 |
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| Polarare Oberfläche (TPSA) | 0 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 0 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 6 |
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| Formalladung | 0 |
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| Komplexität | 35 |
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| Kovats Retention Index | 827 |
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| Schmelzpunkt | -36.84°C (estimate) |
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| Siedepunkt | 133 °C |
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| Dichte | 1.35 |
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| Brechungsindex | 1.4670-1.4700 |
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| Aggregatzustand | clear liquid |
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| Farbe | Colorless to Almost colorless |
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| Henry-Konstante | 3.1×10-2 mol/(m3Pa) at 25℃, Duchowicz et al. (2020) |
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| EPA chemische Informationen | 1,1,2-Trichloropropane (598-77-6) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH225 (50%): Highly Flammable liquid and vapor [Danger Flammable liquids]H226 (50%): Flammable liquid and vapor [Warning Flammable liquids]H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H331 (100%): Toxic if inhaled [Danger Acute toxicity, inhalation]P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P316, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 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. |
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| Hazard Classes and Categories | Flam. Liq. 3 (50%)Acute Tox. 4 (100%)Acute Tox. 3 (100%) |
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| Zielorgane | EndocrineHepaticUrinary |
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| EPA IRIS Information | 1,1,2-TrichloropropaneEndocrineHepaticUrinary5 x 10 ^-3 mg/kg-day |
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| RAIS Toxicity Values | 0.005IRIS Current0.01PPRTV Current |
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| EPA Provisional Peer-Reviewed Toxicity Values | 1,1,2-Trichloropropane1 x 10^-2 mg/kg-dayPDF DocumentInadequate information to assess carcinogenic potential2012 |
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