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| Name |
FC 642 |
EINECS | N/A |
| CAS No. | 2282-89-5 | Density | g/cm3 |
| PSA | 29.54000 | LogP | 4.24910 |
| Solubility | N/A | Melting Point |
138-139 °C |
| Formula | C17H27 N O2 . Cl H | Boiling Point | 371.5°Cat760mmHg |
| Molecular Weight | 313.91 | Flash Point | 116°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by subcutaneous route. An eye and skin irritant. When heated to decomposition it emits toxic fumes of NOx and HCl. See also ESTERS. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
L-N,N-Diethylalanine 2,6-diethylphenyl ester hydrochloride |
FC 642 Chemical Properties
Structure of FC 642 (CAS NO.2282-89-5):
.png)
Empirical Formula: C17H28ClNO2
Molecular Weight: 313.8627 g/mol
Flash Point: 116 °C
Enthalpy of Vaporization: 61.85 kJ/mol
Boiling Point: 371.5 °C at 760 mmHg
Vapour Pressure: 1.03E-05 mmHg at 25 °C
IUPAC Name: [1-(2,6-Diethylphenoxy)-1-oxopropan-2-yl]-diethylazanium chloride
Canonical SMILES: CCC1=C(C(=CC=C1)CC)OC(=O)C(C)[NH+](CC)CC.[Cl-]
InChI: InChI=1S/C17H27NO2.ClH/c1-6-14-11-10-12-15(7-2)16(14)20-17(19)13(5)18(8-3)9-4;/h10-13H,6-9H2,1-5H3;1H
InChIKey: OVQHNONIYUKUIV-UHFFFAOYSA-N
FC 642 Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | subcutaneous | 1750mg/kg (1750mg/kg) | Bollettino Chimico Farmaceutico. Vol. 107, Pg. 310, 1968. |
FC 642 Safety Profile
Moderately toxic by subcutaneous route. An eye and skin irritant. When heated to decomposition FC 642 (CAS NO.2282-89-5) emits toxic fumes of NOx and HCl. See also ESTERS.
FC 642 Specification
FC 642 ,its cas register number is 2282-89-5. It also can be called Alanine, N,N-diethyl-, 2,6-diethylphenyl ester, L-,
hydrochloride ; and L-N,N-Diethylalanine 2,6-diethylphenyl ester hydrochloride .
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