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Substance Name: Fenpentadiol [INN:DCF]
RN: 15687-18-0
UNII: BLO7300903
InChIKey: SNJDSTGQYRTZJT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H17-Cl-O2

Molecular Weight

  • 228.717
 
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Names and Synonyms

Name of Substance

  • Fenpentadiol
  • Fenpentadiol [INN:DCF]

Synonyms

  • 2-(p-Chlorophenyl)-4-methylpentane-2,4-diol
  • 2-Methyl-4-(p-chlorophenyl)-2,4-pentanediol
  • BRN 2108769
  • EINECS 239-782-5
  • Fempentadiol
  • Fempentadiol [INN-Spanish]
  • Fenpentadiol
  • Fenpentadiolum
  • Fenpentadiolum [INN-Latin]
  • RD 292
  • RD 6002
  • Tredum
  • UNII-BLO7300903

Systematic Names

  • 2,4-Pentanediol, 2-(p-chlorophenyl)-4-methyl-
  • 2-(4-Chlorophenyl)-4-methyl-2,4-pentanediol
  • 2-(p-Chlorophenyl)-4-methyl-2,4-pentanediol
  • Fenpentadiol

Registry Numbers

CAS Registry Number

  • 15687-18-0

FDA UNII

  • BLO7300903

System Generated Number

  • 0015687180

Structure Descriptors

InChI

1S/C12H17ClO2/c1-11(2,14)8-12(3,15)9-4-6-10(13)7-5-9/h4-7,14-15H,8H2,1-3H3

InChIKey

SNJDSTGQYRTZJT-UHFFFAOYSA-N

Smiles

C([C@@](c1ccc(cc1)Cl)(O)C)C(O)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 940mg/kg (940mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: MUSCLE WEAKNESS
Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 9, 1971.
rat LD50 oral 1140mg/kg (1140mg/kg) BEHAVIORAL: EXCITEMENT

PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE

GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"
Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 9, 1971.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 76.5 deg C   EXP
log P (octanol-water) 2.890 (none)   EST
Atmospheric OH Rate Constant 1.70E-11 cm3/molecule-sec 25 EST

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