Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Morpholine, 4-methyl-2-phenyl-2-(2-propenyloxy)-, hydrochloride
RN: 124497-81-0
InChIKey: NKEGDQGNYVIXQQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H19-N-O2.Cl-H

Molecular Weight

  • 269.77
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 4-Methyl-2-phenyl-2-(2-propenyloxy)morpholine hydrochloride

Systematic Name

  • Morpholine, 4-methyl-2-phenyl-2-(2-propenyloxy)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 124497-81-0

System Generated Number

  • 0124497810

Molecular Formulas

Molecular Formula

  • C14-H19-N-O2.Cl-H

Molecular Formula Fragments

  • C14-H19-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H19NO2.ClH/c1-3-10-16-14(12-15(2)9-11-17-14)13-7-5-4-6-8-13;/h3-8H,1,9-12H2,2H3;1H

InChIKey

NKEGDQGNYVIXQQ-UHFFFAOYSA-N

Smiles

CN1CCOC(C1)(c2ccccc2)OCC=C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 220mg/kg (220mg/kg) SKIN AND APPENDAGES (SKIN): HAIR: OTHER

BEHAVIORAL: COMA

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 24, Pg. 179, 1989.

Physical Properties

Physical Property Value Units Temp (deg C) Source
pKa Dissociation Constant 7.09 (none)   EXP
log P (octanol-water) 2.09 (none)   EXP
Water Solubility 4880 mg/L 25 EST
Vapor Pressure 2.00E-04 mm Hg 25 EST
Henry's Law Constant 1.56E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.71E-10 cm3/molecule-sec 25 EST

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