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Substance Name: Ethyl anthranilate
RN: 87-25-2
UNII: 38Y050IUE4
InChIKey: TWLLPUMZVVGILS-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C9-H11-N-O2

Molecular Weight

  • 165.1909
 
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Names and Synonyms

Name of Substance

  • Ethyl anthranilate

Synonyms

  • 2-(Ethoxycarbonyl)aniline
  • 2-Aminobenzoic acid ethyl ester
  • 2-Carboethoxyaniline
  • 4-14-00-01008 (Beilstein Handbook Reference)
  • AI3-02377
  • Anthranilic acid, ethyl ester
  • Benzoic acid, 2-amino-, ethyl ester
  • Benzoic acid, o-amino-, ethyl ester
  • BRN 0878874
  • CCRIS 6238
  • EINECS 201-735-1
  • Ethyl 2-aminobenzoate
  • Ethyl anthranilate
  • Ethyl o-aminobenzoate
  • FEMA No. 2421
  • HSDB 404
  • NSC 4146
  • o-(Ethoxycarbonyl)aniline
  • UNII-38Y050IUE4

Systematic Names

  • Anthranilic acid, ethyl ester (6CI,7CI,8CI)
  • Benzoic acid, 2-amino-, ethyl ester
  • Benzoic acid, o-amino-, ethyl ester
  • Ethyl anthranilate

Superlist Names

  • Anthranilic acid, ethyl ester
  • Ethyl anthranilate

Registry Numbers

CAS Registry Number

  • 87-25-2

FDA UNII

  • 38Y050IUE4

System Generated Number

  • 0000087252

Structure Descriptors

InChI

InChI=1S/C9H11NO2/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6H,2,10H2,1H3

InChIKey

TWLLPUMZVVGILS-UHFFFAOYSA-N

Smiles

CCOC(=O)c1ccccc1N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 3750mg/kg (3750mg/kg)   Food and Cosmetics Toxicology. Vol. 14, Pg. 759, 1976.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 13 deg C   EXP
Boiling Point 268 deg C   EXP
pKa Dissociation Constant 2.18 (none) 25 EXP
log P (octanol-water) 2.57 (none)   EXP
Water Solubility 414 mg/L 25 EST
Vapor Pressure 2.32E-03 mm Hg 25 EST
Henry's Law Constant 1.63E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.65E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.