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Substance Name: Beclobrate [INN:BAN]
RN: 55937-99-0
UNII: USZ5MY269R
InChIKey: YWQGBCXVCXMSLJ-UHFFFAOYSA-N

Classification Codes

  • Antilipemic Agents
  • Antimetabolites
  • Drug / Therapeutic Agent
  • Hypolipidemic Agents
  • Lipid Regulating Agents

Molecular Formula

  • C20-H23-Cl-O3

Molecular Weight

  • 346.852
 
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Names and Synonyms

Name of Substance

  • Beclobrate
  • Beclobrate [INN:BAN]

Synonyms

  • (+-)-2-(4-((4'-Chlorphenyl)methyl)-phenoxy)-2-methylbutansaure-ethylester
  • (+-)-2-(4-((4'-Chlorphenyl)methyl)-phenoxy)-2-methylbutansaure-ethylester [German]
  • (+-)-2-(4-(4-Chlorobenzyl)phenoxy)-2-methylbutyric acid ethyl ester
  • (+-)-Ethyl 2-(4-(4-chlorobenzyl)phenoxy)-2-methylbutyrate
  • Beclobrate
  • Beclobrato
  • Beclobrato [INN-Spanish]
  • Beclobrato [Spanish]
  • Beclobratum
  • Beclobratum [INN-Latin]
  • Butyric acid, 2-(4-(4-chlorobenzyl)phenoxy)-2-methyl-, ethyl ester, (+-)-
  • EINECS 259-912-4
  • Ethyl (+-)-2-((alpha-(p-chlorophenyl)-p-tolyl)oxy)-2-methylbutyrate
  • Ethyl 2-(4-((4-chlorophenyl)methyl)phenoxy)-2-methylbutanoate
  • Sgd 247-74
  • Sgd 24774
  • UNII-USZ5MY269R

Systematic Names

  • Beclobrate
  • Butanoic acid, 2-(4-((4-chlorophenyl)methyl)phenoxy)-2-methyl-, ethyl ester, (+-)-
  • Ethyl (+-)-2-((alpha-(p-chlorophenyl)-p-tolyl)oxy)-2-methylbutyrate

Registry Numbers

CAS Registry Number

  • 55937-99-0

FDA UNII

  • USZ5MY269R

Other Registry Number

  • 57081-61-5

System Generated Number

  • 0055937990

Structure Descriptors

InChI

1S/C20H23ClO3/c1-4-20(3,19(22)23-5-2)24-18-12-8-16(9-13-18)14-15-6-10-17(21)11-7-15/h6-13H,4-5,14H2,1-3H3

InChIKey

YWQGBCXVCXMSLJ-UHFFFAOYSA-N

Smiles

c1c(Cc2ccc(cc2)O[C@@](C)(CC)C(OCC)=O)ccc(Cl)c1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 8gm/kg (8000mg/kg)   United States Patent Document. Vol. #4214095,
rat LD50 oral 9gm/kg (9000mg/kg)   Drugs of the Future. Vol. 5, Pg. 237, 1980.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 6.130 (none)   EST
Atmospheric OH Rate Constant 3.44E-11 cm3/molecule-sec 25 EST

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