-
Name
prop-2-enoic acid - trichloroacetic acid (1:1)
- EINECS
- CAS No. 71073-91-1
- Density g/cm3
- Solubility
- Melting Point
- Formula C2HCl3O2•3/2 C3H4O2
- Boiling Point 196.5°Cat760mmHg
- Molecular Weight 265.49
- Flash Point 66.3°C
- Transport Information
- Appearance
- Safety Poison by intraperitoneal route. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of Cl−.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms
- PSA
- LogP
Acetic acid, trichloro-, telomer with 2-propenoic acid Chemical Properties
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
Acetic acid, trichloro-, telomer with 2-propenoic acid Toxicity Data With Reference
| 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. |
Acetic acid, trichloro-, telomer with 2-propenoic acid Safety Profile
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 Specification
Acetic acid, trichloro-, telomer with 2-propenoic acid (CAS NO.71073-91-1) is also called as 2-Propenoic acid, telomer with trichloroacetic acid .
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