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Substance Name: 1-Chloro-2-methylanthraquinone
RN: 129-35-1
UNII: 1R4Z9RL2L3
InChIKey: NMFBXBSNLQNQKL-UHFFFAOYSA-N

Molecular Formula

  • C15-H9-Cl-O2

Molecular Weight

  • 256.687
 
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Names and Synonyms

Name of Substance

  • 1-Chloro-2-methylanthraquinone

Synonyms

  • 1-Chloro-2-methylanthraquinone
  • 9,10-Anthracenedione, 1-chloro-2-methyl-
  • Anthraquinone, 1-chloro-2-methyl-
  • EINECS 204-940-4
  • HSDB 2582
  • NSC 504
  • UNII-1R4Z9RL2L3

Systematic Names

  • 1-Chloro-2-methylanthraquinone
  • 9,10-Anthracenedione, 1-chloro-2-methyl-
  • Anthraquinone, 1-chloro-2-methyl- (8CI)

Registry Numbers

CAS Registry Number

  • 129-35-1

FDA UNII

  • 1R4Z9RL2L3

System Generated Number

  • 0000129351

Structure Descriptors

InChI

1S/C15H9ClO2/c1-8-6-7-11-12(13(8)16)15(18)10-5-3-2-4-9(10)14(11)17/h2-7H,1H3

InChIKey

NMFBXBSNLQNQKL-UHFFFAOYSA-N

Smiles

c12c(C(c3ccccc3C1=O)=O)ccc(c2Cl)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 170.5 deg C   EXP
log P (octanol-water) 4.540 (none)   EST
Water Solubility 0.225 mg/L 25 EST
Vapor Pressure 6.39E-07 mm Hg 25 EST
Henry's Law Constant 2.60E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.53E-12 cm3/molecule-sec 25 EST

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