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Substance Name: 2-Acetylnaphthalene
RN: 93-08-3
UNII: 21D49LOP2T
InChIKey: XSAYZAUNJMRRIR-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C12-H10-O

Molecular Weight

  • 170.21
 
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Names and Synonyms

Name of Substance

  • 2-Acetylnaphthalene

Synonyms

  • 1-(2-Naphthalenyl)ethanone
  • 2'-Acetonaphthone
  • 2-Acetonaphthone
  • 2-Acetylnaphthalene
  • 2-Naphthyl methyl ketone
  • 4-07-00-01294 (Beilstein Handbook Reference)
  • Acetonaphthone
  • AI3-00642
  • beta-Acetonaphthalene
  • beta-Acetylnaphthalene
  • beta-Naphthyl methyl ketone
  • BRN 0774965
  • CCRIS 6558
  • Cetone D
  • EC 202-216-2
  • EINECS 202-216-2
  • Ethanone, 1-(2-naphthalenyl)-
  • FEMA No. 2723
  • Ketone, methyl 2-naphthyl
  • Methyl 2-naphthyl ketone
  • Methyl beta-naphthyl ketone
  • NSC 7658
  • Oranger crystals
  • Oranger cyrstals
  • UNII-21D49LOP2T

Systematic Names

  • 2'-Acetonaphthone
  • Ethanone, 1-(2-naphthalenyl)-
  • Methyl beta-naphthyl ketone

Superlist Name

  • Methyl beta-naphthyl ketone

Registry Numbers

CAS Registry Number

  • 93-08-3

FDA UNII

  • 21D49LOP2T

System Generated Number

  • 0000093083

Structure Descriptors

InChI

1S/C12H10O/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h2-8H,1H3

InChIKey

XSAYZAUNJMRRIR-UHFFFAOYSA-N

Smiles

c12c(ccc(c1)C(C)=O)cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 599mg/kg (599mg/kg)   Medizin und Ernaehrung. Vol. 8, Pg. 244, 1967.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 56 deg C   EXP
Boiling Point 302 deg C   EXP
log P (octanol-water) 2.850 (none)   EST
Water Solubility 272 mg/L 25 EXP
Henry's Law Constant 9.58E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.98E-11 cm3/molecule-sec 25 EST

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