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Substance Name: 1,3-Benzenediol, 2-methyl-
RN: 608-25-3
UNII: 32W7044A3T
InChIKey: ZTMADXFOCUXMJE-UHFFFAOYSA-N

Molecular Formula

  • C7-H8-O2

Molecular Weight

  • 124.138
 
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Names and Synonyms

Name of Substance

  • 1,3-Benzenediol, 2-methyl-
  • 2-Methyl-1,3-benzenediol
  • 2-Methylresorcinol

Synonyms

  • 1,3-Dihydroxy-2-methylbenzene
  • 2,6-Dihydroxytoluene
  • 2-Methyl-1,3-benzenediol
  • 2-Methyl-1,3-dihydroxybenzene
  • 2-Methylresorcin
  • 2-Methylresorcinol
  • 4-06-00-05877 (Beilstein Handbook Reference)
  • AI3-61050
  • BRN 2042177
  • EC 210-155-8
  • EINECS 210-155-8
  • NSC 66524
  • Toluene-2,6-diol
  • UNII-32W7044A3T

Systematic Names

  • 1,3-Benzenediol, 2-methyl-
  • 2-Methylresorcinol
  • Resorcinol, 2-methyl-

Registry Numbers

CAS Registry Number

  • 608-25-3

FDA UNII

  • 32W7044A3T

System Generated Number

  • 0000608253

Structure Descriptors

InChI

1S/C7H8O2/c1-5-6(8)3-2-4-7(5)9/h2-4,8-9H,1H3

InChIKey

ZTMADXFOCUXMJE-UHFFFAOYSA-N

Smiles

c1(c(cccc1O)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 200mg/kg (200mg/kg)   Journal of the American College of Toxicology. Vol. 5(3), Pg. 167, 1986.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 120 deg C   EXP
Boiling Point 264 deg C   EXP
log P (octanol-water) 1.580 (none)   EST
Water Solubility 2.63E+05 mg/L 25 EXP
Atmospheric OH Rate Constant 2.00E-10 cm3/molecule-sec 25 EST

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