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Substance Name: Febuprol [INN]
RN: 3102-00-9
UNII: B5RKR9Y63Y
InChIKey: WBLXZPHICYCDGN-UHFFFAOYSA-N

Classification Codes

  • Cholagogues and Choleretics
  • Drug / Therapeutic Agent
  • Gastrointestinal Agents

Molecular Formula

  • C13-H20-O3

Molecular Weight

  • 224.298
 
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Names and Synonyms

Name of Substance

  • Febuprol
  • Febuprol [INN]

Synonyms

  • (3-n-Butoxy-2-hydroxypropyl)phenyl ether
  • 1-Butoxy-3-phenoxy-2-propanol
  • 1-n-Butyl-3-phenyl diether glycerol
  • 2-Propanol, 1-n-butoxy-3-phenoxy-
  • 3-n-Butoxy-1-phenoxy-2-propanol
  • 4-06-00-00590 (Beilstein Handbook Reference)
  • BRN 1876848
  • EINECS 221-454-8
  • Febuprol
  • Febuprolum
  • Febuprolum [INN-Latin]
  • H-33
  • K-10033
  • NSC 30151
  • UNII-B5RKR9Y63Y
  • Valbil

Systematic Names

  • 1-Butoxy-3-phenoxy-2-propanol
  • 2-Propanol, 1-butoxy-3-phenoxy-
  • 3-Butoxy-1-phenoxy-propanol-(2)
  • Febuprol

Registry Numbers

CAS Registry Number

  • 3102-00-9

FDA UNII

  • B5RKR9Y63Y

System Generated Number

  • 0003102009

Structure Descriptors

InChI

1S/C13H20O3/c1-2-3-9-15-10-12(14)11-16-13-7-5-4-6-8-13/h4-8,12,14H,2-3,9-11H2,1H3

InChIKey

WBLXZPHICYCDGN-UHFFFAOYSA-N

Smiles

CCCCOC[C@@H](O)COc1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 intravenous 150mg/kg (150mg/kg) LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: ATAXIA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Arzneimittel-Forschung. Drug Research. Vol. 24, Pg. 111, 1974.
dog LD50 oral > 500mg/kg (500mg/kg) BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Arzneimittel-Forschung. Drug Research. Vol. 24, Pg. 111, 1974.
mouse LD50 intraperitoneal 436mg/kg (436mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Arzneimittel-Forschung. Drug Research. Vol. 24, Pg. 111, 1974.
mouse LD50 oral 3050mg/kg (3050mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Arzneimittel-Forschung. Drug Research. Vol. 24, Pg. 111, 1974.
rat LD50 intraperitoneal 400mg/kg (400mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Arzneimittel-Forschung. Drug Research. Vol. 24, Pg. 111, 1974.
rat LD50 oral 2370mg/kg (2370mg/kg) LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: ATAXIA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Arzneimittel-Forschung. Drug Research. Vol. 24, Pg. 111, 1974.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point < 25 deg C   EXP
log P (octanol-water) 2.230 (none)   EST
Atmospheric OH Rate Constant 5.30E-11 cm3/molecule-sec 25 EST

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