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Substance Name: 1,2,4-Trichloro-2-butene
RN: 2431-54-1
InChIKey: SXCATGXBSQWDDJ-RJRFIUFISA-N

Molecular Formula

  • C4-H5-Cl3

Molecular Weight

  • 159.443
 
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Names and Synonyms

Name of Substance

  • 1,2,4-Trichloro-2-butene

Synonyms

  • 1,2,4-Trichlorobutene-2
  • 3-01-00-00744 (Beilstein Handbook Reference)
  • BRN 1740301
  • EINECS 219-398-4

Systematic Names

  • 1,2,4-Trichlorobut-2-ene
  • 2-Butene, 1,2,4-trichloro-

Registry Numbers

CAS Registry Number

  • 2431-54-1

System Generated Number

  • 0002431541

Structure Descriptors

InChI

1S/C4H5Cl3/c5-2-1-4(7)3-6/h1H,2-3H2/b4-1-

InChIKey

SXCATGXBSQWDDJ-RJRFIUFISA-N

Smiles

C(=C\CCl)(\CCl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LC50 inhalation 522mg/m3 (522mg/m3) LIVER: FATTY LIVER DEGERATION

BEHAVIORAL: ATAXIA

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS
Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 34(11), Pg. 60, 1990.
mouse LD50 unreported 318mg/kg (318mg/kg) LIVER: FATTY LIVER DEGERATION

BEHAVIORAL: ATAXIA

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS
Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 34(11), Pg. 60, 1990.
rat LC50 inhalation 385mg/m3 (385mg/m3) LIVER: FATTY LIVER DEGERATION

BEHAVIORAL: ATAXIA

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS
Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 34(11), Pg. 60, 1990.
rat LD50 oral 224mg/kg (224mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 46(1), Pg. 92, 1981.
rat LD50 unreported 210mg/kg (210mg/kg) GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS

BEHAVIORAL: ATAXIA

LIVER: FATTY LIVER DEGERATION
Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 34(11), Pg. 60, 1990.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.090 (none)   EST
Water Solubility 158 mg/L 25 EST
Vapor Pressure 0.819 mm Hg 25 EST
Henry's Law Constant 0.014 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.13E-11 cm3/molecule-sec 25 EST

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