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Tribromoacetaldehyde
Tribromo · BROMAL · Bromal >BROMAL, REDIST. · Tribromoethanal · BroMal, 96.0%(GC) · tribromo-acetaldehyd · TRIBROMOACETALDEHYDE · TRIBROMOACETYLALDEHYDE
Identifikatoren & physikalische Daten
| CAS No. | 115-17-3 |
|---|---|
| Summenformel | C2HBr3O |
| Durchschnittliche Molmasse | 280,74 g/mol |
| Monoisotopische Masse | 277,75775095 g/mol |
| SMILES | O=CC(Br)(Br)Br |
| InChIKey | YTGSYRVSBPFKMQ-UHFFFAOYSA-N |
| PubChem CID | 8256 |
| ChEMBL | CHEMBL3189061 |
| EC No. | 204-067-9 |
| DTXSID | DTXSID1021667 |
Chemische & physikalische Eigenschaften
| XLogP | 2,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 17,1 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 6 |
| Formalladung | 0 |
| Komplexität | 54,3 |
| Stoffklassen | Other Classes -> Aldehydes |
| SpringerMaterials Properties | Boiling point |
| Dichte | 2.662.665 g/mL at 25 °C(lit.) |
| Color/Form | YELLOWISH, OILY LIQUID |
| Löslichkeit | SOL IN WATER, ALCOHOL, ETHERSOL IN ACETONESoluble in water |
| Siedepunkt | ABOUT 174 °C WITH DECOMP174 °C(lit.) |
| Schmelzpunkt | CRYSTALSODOR OF CHLORALPUNGENT TASTEMP: 53.5 °CDIPOLE MOMENT IN BENZENE: 2.56 DDELIQUESCENT /HYDRATE/-57.5 °C |
| Dampfdruck | 1.52 [mmHg] |
| Brechungsindex | INDEX OF REFRACTION: 1.5939 @ 20 °C/Dn20/D 1.584(lit.) |
| Physical Description | Yellowish liquid[Merck Index] Orange liquid[MSDSonline] |
| Other Experimental Properties | FORMS WITH WATER BROMAL HYDRATE WHICH IS SOLID @ TEMP BELOW 50 °CMONOCLINIC PRISMS (OBTAINED FROM WATER CRYSTALLIZING WITH 1 MOLECULE OF SOLVENT/MOLECULE COMPD) |
| Flammpunkt | 150 °F |
| Lagerbedingungen | Refrigerator (+4°C) |
| Merck | 14,1383 |
| BRN | 1098614 |
| Dielektrizitätskonstante | 7.6(21℃) |
| InChI | InChI=1S/C2HBr3O/c3-2(4,5)1-6/h1H |
| InChIKey | YTGSYRVSBPFKMQ-UHFFFAOYSA-N |
| SMILES | C(=O)C(Br)(Br)Br |
| CAS Datenbank | 115-17-3(CAS DataBase Reference) |
| NIST chemische Informationen | Acetaldehyde, tribromo-(115-17-3) |
| EPA chemische Informationen | Acetaldehyde, tribromo- (115-17-3) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]P260, P262, P264, P270, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P361+P364, P363, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Tribromoacetaldehyde: Does not have an individual approval but may be used under an appropriate group standard |
| Gefahrenübersicht | Causes convulsions in lethal-dose feeding studies of mice and rats[RTECS] A corrosive substance that can cause injury to the skin, eyes, and respiratory tractA lachrymatorEffects in lethal-dose animal studies include convulsions[MSDSonline] |
| Hazard Classes and Categories | Acute Tox. 3 (100%) |
| Unerwünschte Wirkungen | Neurotoxin - Other CNS neurotoxin |
| Human Toxicity Excerpts | IN PATIENTS SUFFERING FROM CHRONIC INTOXICATION, GASTRITIS IS COMMON & SKIN ERUPTIONS MAY DEVELOP. PARENCHYMATOUS RENAL INJURY MAY ALSO OCCUR. /CHLORAL HYDRATE/IRRITANT ACTIONS OF CHLORAL HYDRATE GIVE RISE TO UNPLEASANT TASTE...NAUSEA, OCCASIONAL VOMITING, & FLATULENCE. ... UNDESIRABLE CNS EFFECTS INCL LIGHT-HEADEDNESS, MALAISE, ATAXIA, & NIGHTMARES. /CHLORAL HYDRATE/ |
| F | 3-8-10-19 |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN 2927 6.1/PG 1 |
| Zollcode | 29130000 |
| RTECS-Nr. | AB3237500 |
| R-Sätze (R) | 25-27-34 |
| Toxizität | guinea pig,LD50,skin,10uL/kg (0.01mL/kg),National Technical Information Service. Vol. OTS0555937, |
| Gefahrensymbole | T+,Xi,T |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 26-28-36/37/39-45-28A |
| Gefahrenklasse | 8Acute Tox. 2 DermalAcute Tox. 3 OralSkin Corr. 1B |
| Verpackungsgruppe | III |
| Lagerklasse | 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials |
| Gefahrstoffdaten | 115-17-3(Hazardous Substances Data) |
Anwendungen & Verwendung
Verwenden
Organic synthesis.