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Substance Name: R-228
RN: 13290-48-7
InChIKey: RZQSYVFYSMVASQ-UHFFFAOYSA-N

Molecular Formula

  • C13-H17-N-O

Molecular Weight

  • 203.283
 
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Names and Synonyms

Name of Substance

  • R-228

Synonyms

  • AI3-31642
  • R 228

Systematic Names

  • 1-(3-Methylbenzoyl)piperidine
  • Piperidine, 1-(3-methylbenzoyl)-

Registry Numbers

CAS Registry Number

  • 13290-48-7

System Generated Number

  • 0013290487

Structure Descriptors

InChI

1S/C13H17NO/c1-11-6-5-7-12(10-11)13(15)14-8-3-2-4-9-14/h5-7,10H,2-4,8-9H2,1H3

InChIKey

RZQSYVFYSMVASQ-UHFFFAOYSA-N

Smiles

C1CCCCN1C(=O)c1cc(C)ccc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.6 (none)   EXP
Water Solubility 253 mg/L 25 EST
Vapor Pressure 7.83E-05 mm Hg 25 EST
Henry's Law Constant 1.22E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.10E-11 cm3/molecule-sec 25 EST

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