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Substance Name: 1,6-Dibromohexane
RN: 629-03-8
UNII: 7L71Q7Y230
InChIKey: SGRHVVLXEBNBDV-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Skin / Eye Irritant

Molecular Formula

  • C6-H12-Br2

Molecular Weight

  • 243.969
 
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Names and Synonyms

Name of Substance

  • 1,6-Dibromohexane

Synonyms

  • 1,6-Dibromo-n-hexane
  • 1,6-Dibromohexan
  • 1,6-Dibromohexan [German]
  • 1,6-Dibromohexan [German]
  • 1,6-Dibromohexane
  • 4-01-00-00354 (Beilstein Handbook Reference)
  • AI3-11008
  • alpha,omega-Dibromohexane
  • BRN 1236322
  • EC 211-067-2
  • EINECS 211-067-2
  • Hexamethylene dibromide
  • NSC 7306
  • UNII-7L71Q7Y230

Systematic Names

  • 1,6-Dibromohexane
  • Hexane, 1,6-dibromo-

Registry Numbers

CAS Registry Number

  • 629-03-8

FDA UNII

  • 7L71Q7Y230

Other Registry Number

  • 625084-40-4

System Generated Number

  • 0000629038

Structure Descriptors

InChI

1S/C6H12Br2/c7-5-3-1-2-4-6-8/h1-6H2

InChIKey

SGRHVVLXEBNBDV-UHFFFAOYSA-N

Smiles

C(CCCBr)CCBr

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 270mg/kg (270mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 14, Pg. 668, 1964.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -2.30E+00 deg C   EXP
Boiling Point 245.5 deg C   EXP
log P (octanol-water) 3.970 (none)   EST
Atmospheric OH Rate Constant 4.53E-12 cm3/molecule-sec 25 EST

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