-
Name
ethyl 2-[(N,N-diethylglycyl)amino]benzoate
- EINECS
- CAS No. 77967-24-9
- Density g/cm3
- Solubility
- Melting Point
- Formula C15H22N2O3•ClH
- Boiling Point 433.6°Cat760mmHg
- Molecular Weight 314.85
- Flash Point 216°C
- Transport Information
- Appearance
- Safety Moderately toxic by intraperitoneal and subcutaneous routes. An eye irritant. See also ESTERS. When heated to decomposition it emits very toxic fumes of NOx and HCl.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms
- PSA
- LogP
N-(2-Diethylamino)acetylanthranilic acid, ethyl ester, hydrochloride Chemical Properties
IUPAC Name: Ethyl 2-[[2-(diethylamino)acetyl]amino]benzoate hydrochloride
Synonyms of N-(2-Diethylamino)acetylanthranilic acid, ethyl ester, hydrochloride (CAS NO.77967-24-9): Anthranilic acid, N-((diethylamino)acetyl)-, ethyl ester, hydrochloride ; Benzoic acid, 2-(((diethylamino)acetyl)amino)-, ethyl ester, monohydrochloride (9CI)
InChI: InChI=1/C15H22N2O3.ClH/c1-4-17(5-2)11-14(18)16-13-10-8-7-9-12(13)15(19)20-6-3;/h7-10H,4-6,11H2,1-3H3,(H,16,18);1H
InChIKey: CXBREYHMRJDQDD-UHFFFAOYAS
Std. InChI: InChI=1S/C15H22N2O3.ClH/c1-4-17(5-2)11-14(18)16-13-10-8-7-9-12(13)15(19)20-6-3;/h7-10H,4-6,11H2,1-3H3,(H,16,18);1H
Std. InChIKey: CXBREYHMRJDQDD-UHFFFAOYSA-N
CAS NO: 77967-24-9
Molecular Formula: C15H23ClN2O3
Molecular Weight: 314.80772
Molecular Structure : .png)
H bond acceptors: 5
H bond donors: 1
Freely Rotating Bonds: 8
Polar Surface Area: 49.85 Å2
Flash Point: 216 °C
Enthalpy of Vaporization: 68.96 kJ/mol
Boiling Point: 433.6 °C at 760 mmHg
Vapour Pressure: 1.01E-07 mmHg at 25°C
N-(2-Diethylamino)acetylanthranilic acid, ethyl ester, hydrochloride Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | subcutaneous | 2150mg/kg (2150mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 8, Pg. 270, 1958. | |
| rat | LD50 | intraperitoneal | 447mg/kg (447mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 8, Pg. 270, 1958. |
N-(2-Diethylamino)acetylanthranilic acid, ethyl ester, hydrochloride Safety Profile
Moderately toxic by intraperitoneal and subcutaneous routes. An eye irritant. See also ESTERS. When N-(2-Diethylamino)acetylanthranilic acid, ethyl ester, hydrochloride (CAS NO.77967-24-9) is heated to decomposition ,it emits very toxic fumes of NOx and HCl.
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