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Substance Name: 1,4-Benzenedicarboxylic acid, 2,5-dichloro-
RN: 13799-90-1
InChIKey: LMOSYFZLPBHEOW-UHFFFAOYSA-N

Classification Code

  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C8-H4-Cl2-O4

Molecular Weight

  • 235.022
 
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Names and Synonyms

Synonyms

  • AI3-33425
  • EINECS 237-454-6

Systematic Names

  • 1,4-Benzenedicarboxylic acid, 2,5-dichloro-
  • 2,5-Dichloroterephthalic acid

Registry Numbers

CAS Registry Number

  • 13799-90-1

System Generated Number

  • 0013799901

Structure Descriptors

InChI

1S/C8H4Cl2O4/c9-5-1-3(7(11)12)6(10)2-4(5)8(13)14/h1-2H,(H,11,12)(H,13,14)

InChIKey

LMOSYFZLPBHEOW-UHFFFAOYSA-N

Smiles

c1(c(cc(c(c1)Cl)C(=O)O)Cl)C(=O)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 306 deg C   EXP
log P (octanol-water) 2.360 (none)   EST
Atmospheric OH Rate Constant 1.08E-12 cm3/molecule-sec 25 EST

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