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Substance Name: Anthracene-9,10-dione, 1-amino-5,8-dichloro-4-nitro-
RN: 66121-41-3
InChIKey: SODXWGSQGCCZOY-UHFFFAOYSA-N

Molecular Formula

  • C14-H6-Cl2-N2-O4

Molecular Weight

  • 337.117
 
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Names and Synonyms

Synonyms

  • 1-Amino-4-nitro-5,8-dichloroanthraquinone
  • 1-Amino-5,8-dichloro-4-nitroanthracene-9,10-dione

Systematic Name

  • Anthracene-9,10-dione, 1-amino-5,8-dichloro-4-nitro-

Registry Numbers

CAS Registry Number

  • 66121-41-3

System Generated Number

  • 0066121413

Structure Descriptors

InChI

1S/C14H6Cl2N2O4/c15-5-1-2-6(16)10-9(5)13(19)11-7(17)3-4-8(18(21)22)12(11)14(10)20/h1-4H,17H2

InChIKey

SODXWGSQGCCZOY-UHFFFAOYSA-N

Smiles

c12c(C(c3c(ccc(c3C1=O)Cl)Cl)=O)c(ccc2[N+](=O)[O-])N

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 307 deg C   EXP
log P (octanol-water) 5.210 (none)   EST
Water Solubility 0.020 mg/L 25 EST
Henry's Law Constant 2.43E-15 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.32E-12 cm3/molecule-sec 25 EST

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