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Cas Database |
| Name |
tert-Amyl hydroperoxide |
EINECS | 222-321-7 |
| CAS No. | 3425-61-4 | Density | 0.905 g/cm3 |
| PSA | 29.46000 | LogP | 1.66460 |
| Solubility | 63.25g/L at 20℃ | Melting Point |
-70°C |
| Formula | C5H12 O2 | Boiling Point | 144.6ºC |
| Molecular Weight | 104.149 | Flash Point | 41.2 ºC |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by intraperitoneal route. Moderately toxic by ingestion. When heated to decomposition it emits acrid smoke and irritating fumes. See also PEROXIDES, ORGANIC. | Risk Codes | 7-11-52/53-68 |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
tert-Pentylhydroperoxide (6CI,7CI,8CI); 1,1-Dimethylpropyl hydroperoxide; 2-Ethyl-2-propylhydroperoxide; Trigonox TAHP; t-Amyl hydroperoxide; tert-Amyl hydrogenperoxide; tert-Amyl hydroperoxide |
Article Data | 29 |
tert-Amyl hydroperoxide Chemical Properties
Molecular Structure of tert-Pentyl hydroperoxide (CAS NO.3425-61-4):
EINECS: 222-321-7
IUPAC Name: 2-Hydroperoxy-2-methylbutane
Molecular Formula: C5H12O2
Molecular Weight: 104.147580 g/mol
SMILES: O(O)C(C)(C)CC
InChI: InChI=1/C5H12O2/c1-4-5(2,3)7-6/h6H,4H2,1-3H3
InChIKey: XRXANEMIFVRKLN-UHFFFAOYAK
H bond acceptors: 2
H bond donors: 1
Index of Refraction: 1.409
Molar Refractivity: 28.45 cm3
Molar Volume: 114.9 cm3
Surface Tension: 27.1 dyne/cm
Density: 0.905 g/cm3
Flash Point: 41.2 °C
Enthalpy of Vaporization: 44.46 kJ/mol
Boiling Point: 144.6 °C at 760 mmHg
Vapour Pressure: 2.01 mmHg at 25 °C
Water Solubility: 6832 mg/L at 25 °C
BRN of tert-Pentyl hydroperoxide (CAS NO.3425-61-4): 1731878
tert-Amyl hydroperoxide Toxicity Data With Reference
| 1. | orl-rat LD50:863 mg/kg | 85GMAT Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure Izmerov, N.F., et al.,Moscow, USSR.: Centre of International Projects, GKNT,1982,21. | ||
| 2. | ipr-rat LD50:225 mg/kg | GTPZAB Gigiena Truda i Professionalnye Zabolevaniia. Labor Hygiene and Occupational Diseases. 22 (7)(1978),51. | ||
| 3. | orl-mus LD50:450 mg/kg | 85GMAT Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure Izmerov, N.F., et al.,Moscow, USSR.: Centre of International Projects, GKNT,1982,21. | ||
| 4. | ipr-mus LD50:275 mg/kg | 85GMAT Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure Izmerov, N.F., et al.,Moscow, USSR.: Centre of International Projects, GKNT,1982,21. |
tert-Amyl hydroperoxide Consensus Reports
Reported in EPA TSCA Inventory.
tert-Amyl hydroperoxide Safety Profile
Poison by intraperitoneal route. Moderately toxic by ingestion. When heated to decomposition it emits acrid smoke and irritating fumes. See also PEROXIDES, ORGANIC.
tert-Amyl hydroperoxide Specification
tert-Pentyl hydroperoxide with CAS registry number of 3425-61-4 is also called for tert-Amylhydroperoxide ; 1,1-Dimethylpropyl hydroperoxide ; 4-01-00-01671 (Beilstein Handbook Reference) ; Trigonox TAHP ; t-Amyl hydroperoxide ; tert-Amyl hydroperoxide ; Hydroperoxide, 1,1-dimethylpropyl .
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