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Substance Name: 1,5-Hexadiene
RN: 592-42-7
UNII: 4MTZ4764FI
InChIKey: PYGSKMBEVAICCR-UHFFFAOYSA-N

Molecular Formula

  • C6-H10

Molecular Weight

  • 82.145
 
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Names and Synonyms

Name of Substance

  • 1,5-Hexadiene

Synonyms

  • 1,5-Hexadiene
  • alpha,omega-Hexadiene
  • Biallyl
  • Diallyl
  • EINECS 209-754-7
  • Hexadiene (DOT)
  • NSC 60690
  • UNII-4MTZ4764FI

Systematic Name

  • 1,5-Hexadiene

Registry Numbers

CAS Registry Number

  • 592-42-7

FDA UNII

  • 4MTZ4764FI

Other Registry Number

  • 41919-05-5

System Generated Number

  • 0000592427

Structure Descriptors

InChI

1S/C6H10/c1-3-5-6-4-2/h3-4H,1-2,5-6H2

InChIKey

PYGSKMBEVAICCR-UHFFFAOYSA-N

Smiles

C(CC=C)C=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LC50 inhalation > 11pph/4H (110000ppm) BEHAVIORAL: TREMOR

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION
National Technical Information Service. Vol. OTS0571883,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.41E+02 deg C   EXP
Boiling Point 59.4 deg C   EXP
log P (octanol-water) 2.87 (none)   EXP
Water Solubility 169 mg/L 25 EXP
Vapor Pressure 221 mm Hg 25 EXP
Henry's Law Constant 0.141 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.20E-11 cm3/molecule-sec 25 EXP

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