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Cas Database |
| Name |
Methoxyethyl 3-nitrobenzylidenacetoacetate |
EINECS | 254-511-0 |
| CAS No. | 39562-22-6 | Density | 1.266 g/cm3 |
| PSA | 98.42000 | LogP | 2.28000 |
| Solubility | N/A | Melting Point |
72-74 °C |
| Formula | C14H15NO6 | Boiling Point | 433.4 °C at 760 mmHg |
| Molecular Weight | 293.276 | Flash Point | 182 °C |
| Transport Information | N/A | Appearance | a white crystalline |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
2-Methoxyethyl2-(3-nitrobenzylidene)acetoacetate;2-Methoxyethyl 2-(m-nitrobenzylidene)acetoacetate;Methoxyethyl 3 -Nitrobenzylidenacetoacetate; |
Article Data | 8 |
Methoxyethyl 3-nitrobenzylidenacetoacetate Chemical Properties
Molecular Structure of Methoxyethyl 3-nitrobenzylidenacetoacetate (CAS NO.24549-06-2):
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IUPAC Name: 2-Methoxyethyl 2-[(3-nitrophenyl)methylene]acetoacetate
Empirical Formula: C14H15NO6
Molecular Weight: 293.272
H bond acceptors: 7
H bond donors: 0
Freely Rotating Bonds: 8
Index of Refraction: 1.563
Molar Refractivity: 75.24 cm3
Molar Volume: 231.5 cm3
Surface Tension: 48.2 dyne/cm
Density: 1.266 g/cm3
Flash Point: 182 °C
Enthalpy of Vaporization: 68.93 kJ/mol
EINECS: 254-511-0
Melting Point: 72-74 °C
Boiling Point: 433.4 °C at 760 mmHg
Vapour Pressure: 1.03E-07 mmHg at 25°C
Smiles
C(\C(C(=O)C)=C\c1cc(ccc1)[N+](=O)[O-])(=O)OCCOC
Methoxyethyl 3-nitrobenzylidenacetoacetate Toxicity Data With Reference
| 1. | eye-rbt 100 µL/24H MOD | IJTOFN International Journal of Toxicology. 19 (2000),332. | ||
| 2. | orl-rat LD50:5 g/kg | IJTOFN International Journal of Toxicology. 19 (2000),332. | ||
| 3. | ihl-rat LC50:>1401 mg/m3/4H | IJTOFN International Journal of Toxicology. 19 (2000),332. |
Methoxyethyl 3-nitrobenzylidenacetoacetate Safety Profile
Low toxicity by ingestion and inhalation. A moderate eye irritant. When heated to decomposition it emits toxic vapors of NOx.
Methoxyethyl 3-nitrobenzylidenacetoacetate Specification
Methoxyethyl 3-nitrobenzylidenacetoacetate , with CAS number of 24549-06-2, can be called 2-Methoxyethyl 2-((3-nitrophenyl)methylene)acetoacetate ; 2-Methoxyethyl 2-acetyl-3-(3-nitrophenyl)acrylate ; Methoxyrthyl-3-nitrobenzylidenacetoacetate ; 3-Nitrobenzylideneacetoacetate-2-methoxyethylester . It is a a white crystalline.
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