Product Name

  • Name

    methyl 2-[(N,N-diethylglycyl)amino]benzoate hydrochloride

  • EINECS
  • CAS No. 77967-25-0
  • Density
  • Solubility
  • Melting Point
  • Formula C14H20N2O3•ClH
  • Boiling Point 421.8°C at 760 mmHg
  • Molecular Weight 300.82
  • Flash Point 208.9°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 HCl and NOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 77967-25-0 (methyl 2-[(N,N-diethylglycyl)amino]benzoate hydrochloride)
  • Hazard Symbols
  • Synonyms Anthranilic acid,N-((diethylamino)acetyl)-,methyl ester,hydrochloride;C 3089;methyl 2-[[2-(diethylamino)acetyl]amino]benzoate hydrochloride;N-(2-Diethylamino)acetylanthranilic acid,methyl ester,hydrochloride;
  • PSA 62.13000
  • LogP 3.20500

N-(2-Diethylamino)acetylanthranilic acid, methyl ester, hydrochloride Chemical Properties

IUPAC Name: Methyl 2-[[2-(diethylamino)acetyl]amino]benzoate hydrochloride
Synonyms of N-(2-Diethylamino)acetylanthranilic acid, methyl ester, hydrochloride (CAS NO.77967-25-0): Anthranilic acid, N-((diethylamino)acetyl)-, methyl ester, hydrochloride
InChI: InChI=1/C14H20N2O3.ClH/c1-4-16(5-2)10-13(17)15-12-9-7-6-8-11(12)14(18)19-3;/h6-9H,4-5,10H2,1-3H3,(H,15,17);1H
InChIKey: DWKMYDJSDITBKS-UHFFFAOYAV
Std. InChI: InChI=1S/C14H20N2O3.ClH/c1-4-16(5-2)10-13(17)15-12-9-7-6-8-11(12)14(18)19-3;/h6-9H,4-5,10H2,1-3H3,(H,15,17);1H
Std. InChIKey: DWKMYDJSDITBKS-UHFFFAOYSA-N
CAS NO: 77967-25-0
Molecular Formula: C14H21ClN2O3
Molecular Weight: 300.7811
Molecular Structure :
H bond acceptors: 5
H bond donors: 1
Freely Rotating Bonds: 7
Polar Surface Area: 49.85 Å2
Flash Point: 208.9 °C
Enthalpy of Vaporization: 67.58 kJ/mol
Boiling Point: 421.8 °C at 760 mmHg
Vapour Pressure: 2.54E-07 mmHg at 25°C

N-(2-Diethylamino)acetylanthranilic acid, methyl ester, hydrochloride Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 2400mg/kg (2400mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 8, Pg. 270, 1958.
rat LD50 intraperitoneal 615mg/kg (615mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 8, Pg. 270, 1958.

N-(2-Diethylamino)acetylanthranilic acid, methyl ester, hydrochloride Safety Profile

Moderately toxic by intraperitoneal and subcutaneous routes. An eye irritant. See also ESTERS. When N-(2-Diethylamino)acetylanthranilic acid, methyl ester, hydrochloride (CAS NO.77967-25-0) is heated to decomposition, it emits very toxic fumes of HCl and NOx.

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