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Substance Name: 2,4-Dichlorobenzenemethanol
RN: 1777-82-8
UNII: 1NKX3648J9
InChIKey: DBHODFSFBXJZNY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H6-Cl2-O

Molecular Weight

  • 177.029
 
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Names and Synonyms

Name of Substance

  • 2,4-Dichlorobenzenemethanol
  • 2,4-Dichlorobenzyl alcohol
  • Dichlorobenzyl alcohol

Synonyms

  • 2,4-Dichlorobenzenemethanol
  • 2,4-Dichlorobenzyl alcohol
  • 4-06-00-02597 (Beilstein Handbook Reference)
  • AI3-20619
  • BRN 1448652
  • Dybenal
  • EINECS 217-210-5
  • Myacide SP
  • NSC 15635
  • Rapidosept
  • UNII-1NKX3648J9

Systematic Names

  • 2,4-Dichlorobenzyl alcohol
  • Benzenemethanol, 2,4-dichloro-
  • Benzenemethanol, 2,4-dichloro- (9CI)
  • Benzyl alcohol, 2,4-dichloro-

Registry Numbers

CAS Registry Number

  • 1777-82-8

FDA UNII

  • 1NKX3648J9

System Generated Number

  • 0001777828

Structure Descriptors

InChI

1S/C7H6Cl2O/c8-6-2-1-5(4-10)7(9)3-6/h1-3,10H,4H2

InChIKey

DBHODFSFBXJZNY-UHFFFAOYSA-N

Smiles

c1(c(cc(Cl)cc1)Cl)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2300mg/kg (2300mg/kg)   Cosmetics and Toiletries. Vol. 95(6), Pg. 59, 1980.
mouse LD50 subcutaneous 1700mg/kg (1700mg/kg)   Cosmetics and Toiletries. Vol. 95(6), Pg. 59, 1980.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 59.5 deg C   EXP
log P (octanol-water) 2.360 (none)   EST
Water Solubility 1000 mg/L 20 EXP
Atmospheric OH Rate Constant 4.58E-12 cm3/molecule-sec 25 EST

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