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Substance Name: 1,3-Dichloro-2-butene
RN: 926-57-8
UNII: JI8009BEDK
InChIKey: WLIADPFXSACYLS-DUXPYHPUSA-N

Molecular Formula

  • C4-H6-Cl2

Molecular Weight

  • 124.997
 
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Names and Synonyms

Name of Substance

  • 1,3-Dichloro-2-butene

Synonyms

  • 1,3-Dichloro-2-butene
  • 1,3-Dichlorobutylene
  • 2-Butene, 1,3-dichloro-
  • BRN 0906754
  • EC 213-138-3
  • EINECS 213-138-3
  • HSDB 1500
  • NSC 8749
  • UNII-JI8009BEDK

Systematic Names

  • 1,3-Dichlorobut-2-ene
  • 2-Butene, 1,3-dichloro-

Superlist Names

  • 1,3-Dichlorobutene-2
  • 2-Butene, 1,3-dichloro-

Registry Numbers

CAS Registry Number

  • 926-57-8

FDA UNII

  • JI8009BEDK

System Generated Number

  • 0000926578

Structure Descriptors

InChI

1S/C4H6Cl2/c1-4(6)2-3-5/h2H,3H2,1H3/b4-2+

InChIKey

WLIADPFXSACYLS-DUXPYHPUSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LC50 inhalation 4400mg/m3/2H (4400mg/m3)   Zhurnal Eksperimental'noi i Klinicheskoi Meditsiny. Journal of Experimental and Clinical Medicine. Vol. 9(6), Pg. 66, 1969.
rat LC50 inhalation 3930mg/m3/4H (3930mg/m3)   Zhurnal Eksperimental'noi i Klinicheskoi Meditsiny. Journal of Experimental and Clinical Medicine. Vol. 9(6), Pg. 66, 1969.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 131 deg C   EXP
log P (octanol-water) 2.840 (none)   EST
Water Solubility 363 mg/L 25 EST
Vapor Pressure 12.6 mm Hg 25 EST
Henry's Law Constant 6.64E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.44E-11 cm3/molecule-sec 25 EST

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