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Name |
Acetic acid, trichloro-, telomer with 2-propenoic acid |
EINECS | N/A |
CAS No. | 71073-91-1 | Density | g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
N/A |
Formula | C2HCl3O2•3/2 C3H4O2 | Boiling Point | 196.5°Cat760mmHg |
Molecular Weight | 265.49 | Flash Point | 66.3°C |
Transport Information | N/A | Appearance | N/A |
Safety | Poison by intraperitoneal route. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of Cl−. | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
N/A |
The Molecular Structure of Acetic acid, trichloro-, telomer with 2-propenoic acid (CAS NO.71073-91-1):
Molecular Formula: C5H5Cl3O4
Molecular Weight: 235.449800 g/mol
Classification: Drug / Therapeutic Agent
IUPAC: prop-2-enoic acid; 2,2,2-trichloroacetic acid
Nominal Mass: 234 Da
Average Mass: 235.4498 Da
Monoisotopic Mass: 233.925342 Da
ACD/LogP: 1.67
ACD/LogD (pH 5.5): -2.07
ACD/LogD (pH 7.4): -2.08
ACD/BCF (pH 5.5): 1
ACD/BCF (pH 7.4): 1
ACD/KOC (pH 5.5): 1
ACD/KOC (pH 7.4): 1
Polar Surface Area: 26.3Å2
Flash Point: 66.3 °C
Enthalpy of Vaporization: 47.69 kJ/mol
Boiling Point: 196.5 °C at 760 mmHg
Vapour Pressure: 0.17 mmHg at 25°C
Smiles:C(C(Cl)(Cl)Cl)(=O)O.C(C=C)(=O)O
1. | orl-mus LD50:2750 mg/kg | EJMCA5 European Journal of Medicinal Chemistry. Chimie Therapeutique. 14 (1979),119. | ||
2. | ipr-mus LD50:300 mg/kg | EJMCA5 European Journal of Medicinal Chemistry. Chimie Therapeutique. 14 (1979),119. |
Poison by intraperitoneal route. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of Cl−.
Acetic acid, trichloro-, telomer with 2-propenoic acid (CAS NO.71073-91-1) is also called as 2-Propenoic acid, telomer with trichloroacetic acid .