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Substance Name: 1,2,4-Benzenetriol
RN: 533-73-3
UNII: 173O8B04RD
InChIKey: GGNQRNBDZQJCCN-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C6-H6-O3

Molecular Weight

  • 126.11
 
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Names and Synonyms

Name of Substance

  • 1,2,4-Benzenetriol
  • 1,2,4-Trihydroxybenzene
  • Hydroxyhydroquinone

Synonyms

  • 1,2,4-Trihydroxybenzene
  • 1,3,4-Trihydroxybenzene
  • 2,5-Dihydroxyphenol
  • 4-06-00-07338 (Beilstein Handbook Reference)
  • AI3-19361
  • BRN 2042863
  • CCRIS 2987
  • EINECS 208-575-1
  • Hydroquinone, hydroxy-
  • Hydroxyhydroquinone
  • Hydroxyquinol
  • NSC 2818
  • Oxyhydrochinon
  • Oxyhydrochinon [German]
  • Oxyhydroquinone
  • UNII-173O8B04RD

Systematic Names

  • 1,2,4-Benzenetriol
  • 1,2,4-Trihydroxybenzene

Registry Numbers

CAS Registry Number

  • 533-73-3

FDA UNII

  • 173O8B04RD

System Generated Number

  • 0000533733

Structure Descriptors

InChI

1S/C6H6O3/c7-4-1-2-5(8)6(9)3-4/h1-3,7-9H

InChIKey

GGNQRNBDZQJCCN-UHFFFAOYSA-N

Smiles

c1(c(ccc(c1)O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 25mg/kg (25mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)

BEHAVIORAL: ATAXIA
National Technical Information Service. Vol. OTS0540939,
mouse LD50 subcutaneous 122mg/kg (122mg/kg)   Industrial Health. Vol. 5, Pg. 143, 1967.
mouse LDLo oral 10mg/kg (10mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
National Technical Information Service. Vol. OTS0540939,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 140.5 deg C   EXP
log P (octanol-water) 0.550 (none)   EST
Water Solubility 1.22E+05 mg/L 25 EST
Vapor Pressure 1.60E-04 mm Hg 25 EST
Henry's Law Constant 6.07E-15 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.00E-10 cm3/molecule-sec 25 EST

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