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Cas Database |
| Name |
N,N-Diethyl-o-toluamide |
EINECS | N/A |
| CAS No. | 2728-04-3 | Density | 0.985g/cm3 |
| PSA | 20.31000 | LogP | 2.47700 |
| Solubility | N/A | Melting Point |
49-50 °C |
| Formula | C12H17 N O | Boiling Point | 316.7°Cat760mmHg |
| Molecular Weight | 191.273 | Flash Point | 139.8°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by ingestion. A human skin irritant. When heated to decomposition it emits toxic fumes of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
o-Toluamide,N,N-diethyl- (6CI,7CI,8CI); N,N-Diethyl-2-methylbenzamide;N,N-Diethyl-o-toluamide; NSC 405380; o-DEET; o-DETA |
Article Data | 26 |
N,N-Diethyl-o-toluamide Chemical Properties
IUPAC Name: N,N-Diethyl-2-methylbenzamide
Synonyms of N,N-Diethyl-o-toluamide (CAS NO.2728-04-3): 2-Methyl-N,N-diethylbenzamide ; Benzamide, N,N-diethyl-2-methyl- ; N,N-Diethyl-2-methylbenzamide ; o-Toluamide, N,N-diethyl-
InChI: InChI=1/C17H28N2O2.2C4H4O4/c1-4-17(11-12-18-13-14-19(5-2)6-3)20-15-9-7-8-10-16(15)21-17;2*5-3(6)1-2-4(7)8/h7-10,18H,4-6,11-14H2,1-3H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChI: InChI=1/C12H17NO/c1-4-13(5-2)12(14)11-9-7-6-8-10(11)3/h6-9H,4-5H2,1-3H3
InChIKey: KUYQDJOFVBGZID-UHFFFAOYAO
Std. InChI: InChI=1S/C12H17NO/c1-4-13(5-2)12(14)11-9-7-6-8-10(11)3/h6-9H,4-5H2,1-3H3
Std. InChIKey: KUYQDJOFVBGZID-UHFFFAOYSA-N
CAS NO: 2728-04-3
Molecular Formula: C12H17NO
Molecular Weight: 191.2695
Molecular Structure : .png)
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 3
Polar Surface Area: 20.31 Å2
Index of Refraction: 1.517
Molar Refractivity: 58.72 cm3
Molar Volume: 194 cm3
Surface Tension: 35.9 dyne/cm
Density: 0.985 g/cm3
Flash Point: 139.8 °C
Enthalpy of Vaporization: 55.81 kJ/mol
Boiling Point: 316.7 °C at 760 mmHg
Vapour Pressure: 0.000403 mmHg at 25°C
N,N-Diethyl-o-toluamide Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rat | LD50 | oral | 1210mg/kg (1210mg/kg) | Toxicology and Applied Pharmacology. Vol. 7, Pg. 772, 1965. |
N,N-Diethyl-o-toluamide Safety Profile
Moderately toxic by ingestion. A human skin irritant. When N,N-Diethyl-o-toluamide (CAS NO.2728-04-3) is heated to decomposition, it emits toxic fumes of NOx.
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