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CAS No.: | 2282-89-5 |
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Name: | L-N,N-Diethylalanine 2,6-diethylphenyl ester hydrochloride |
Molecular Structure: | |
Formula: | C17H27 N O2 . Cl H |
Molecular Weight: | 313.91 |
Synonyms: | L-N,N-Diethylalanine 2,6-diethylphenyl ester hydrochloride |
Density: | g/cm3 |
Melting Point: | 138-139 °C |
Boiling Point: | 371.5°Cat760mmHg |
Flash Point: | 116°C |
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. |
PSA: | 29.54000 |
LogP: | 4.24910 |
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Structure of FC 642 (CAS NO.2282-89-5):
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
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. |
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 ,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 .