Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 5-Bromosalicylic acid
RN: 89-55-4
UNII: 6907950MYK
InChIKey: IEJOONSLOGAXNO-UHFFFAOYSA-N

Molecular Formula

  • C7-H5-Br-O3

Molecular Weight

  • 217.0175
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • 5-Bromosalicylic acid

Name of Substance

  • 5-Bromosalicylic acid

Synonyms

  • 2-Hydroxy-5-bromobenzoic acid
  • 4-10-00-00217 (Beilstein Handbook Reference)
  • 5-Bromo-2-hydroxybenzoic acid
  • 5-Bromosalicylic acid
  • AI3-22146
  • Benzoic acid, 3-bromo-6-hydroxy-
  • BRN 2209121
  • EINECS 201-917-0
  • NSC 3981
  • UNII-6907950MYK

Systematic Names

  • 5-Bromosalicylic acid
  • Benzoic acid, 5-bromo-2-hydroxy-
  • Salicylic acid, 5-bromo-

Registry Numbers

CAS Registry Number

  • 89-55-4

FDA UNII

  • 6907950MYK

Other Registry Number

  • 50516-75-1

System Generated Number

  • 0000089554

Structure Descriptors

InChI

1S/C7H5BrO3/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,9H,(H,10,11)

InChIKey

IEJOONSLOGAXNO-UHFFFAOYSA-N

Smiles

c1(c(ccc(c1)Br)O)C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100mg/kg (100mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04478,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 169.8 deg C   EXP
pKa Dissociation Constant 2.66 (none) 25 EXP
log P (octanol-water) 3.23 (none)   EXP
Water Solubility 237 mg/L 25 EST
Vapor Pressure 1.07E-05 mm Hg 25 EST
Henry's Law Constant 5.66E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.20E-12 cm3/molecule-sec 25 EST

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