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Substance Name: Chlorendic acid
RN: 115-28-6
InChIKey: DJKGDNKYTKCJKD-UHFFFAOYSA-N

Molecular Formula

  • C9-H4-Cl6-O4

Molecular Weight

  • 388.845
 

Classification Codes

Classification Codes

  • Mutation Data
  • Skin / Eye Irritant
  • Tumor Data

Superlist Classification Codes

  • Overall Carcinogenic Evaluation: Group 2B
  • Reasonably Anticipated to be a Carcinogen
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Names and Synonyms

Name of Substance

  • Chlorendic acid

Synonyms

  • 1,4,5,6,7,7-Hexachloro-5-norbornene-2,3-dicarboxylic acid
  • 1,4,5,6,7,7-Hexachlorobicyclo(2.2.1)-5-heptene-2,3-dicarboxylic acid
  • 5-Norbornene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-
  • CCRIS 896
  • Chlorendic acid
  • Chlorendic acid (VAN)
  • EINECS 204-078-9
  • Het acid
  • Hexachloro-endo-methylenetetrahydrophthalic acid
  • Hexachloroendomethylenetetrahydrophthalic acid
  • HSDB 2915
  • Kyselina 1,2,3,4,7,7-hexachlorbicyklo(2,2,1)hept-2-en-5,6-dikarboxylova
  • Kyselina 1,2,3,4,7,7-hexachlorbicyklo(2,2,1)hept-2-en-5,6-dikarboxylova [Czech]
  • Kyselina 3,6-endomethylen-3,4,5,6,7,7-hexachlor-delta(sup 4)-tetrahydroftalova
  • Kyselina 3,6-endomethylen-3,4,5,6,7,7-hexachlor-delta(sup 4)-tetrahydroftalova [Czech]
  • Kyselina 3,6-endomethylen-3,4,5,6,7,7-hexachlor-delta(sup 4)-tetrahyroftalova
  • Kyselina 3,6-endomethylen-3,4,5,6,7,7-hexachlor-delta(sup 4)-tetrahyroftalova [Czech]
  • Kyselina het
  • Kyselina het [Czech]
  • NCI-C55072
  • NSC 22231

Systematic Names

  • 1,4,5,6,7,7-Hexachloro-8,9,10-trinorborn-5-ene-2,3-dicarboxylic acid
  • 5-Norbornene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-
  • Bicyclo(2.2.1)hept-5-ene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-
  • Chlorendic acid

Superlist Names

  • 5-Norbornene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-
  • Chlorendic acid

Registry Numbers

CAS Registry Number

  • 115-28-6

Other Registry Numbers

  • 5343-97-5
  • 7374-78-9

System Generated Number

  • 0000115286

Structure Descriptors

InChI

1S/C9H4Cl6O4/c10-3-4(11)8(13)2(6(18)19)1(5(16)17)7(3,12)9(8,14)15/h1-2H,(H,16,17)(H,18,19)

InChIKey

DJKGDNKYTKCJKD-UHFFFAOYSA-N

Smiles

C1([C@@]2([C@@H]([C@@H](C(O)=O)[C@@]1(Cl)C(=C2Cl)Cl)C(O)=O)Cl)(Cl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LC inhalation > 790mg/m3/4H (790mg/m3)   National Technical Information Service. Vol. OTS0537100,
rat LD oral > 1gm/kg (1000mg/kg)   National Technical Information Service. Vol. OTS0535786,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 209 deg C   EXP
log P (octanol-water) 3.140 (none)   EST
Water Solubility 3500 mg/L 25 EXP
Vapor Pressure 3.04E-08 mm Hg 25 EST
Henry's Law Constant 1.12E-13 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.18E-12 cm3/molecule-sec 25 EST

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