1,6-HEPTADIEN-4-OL, 4-ETHYL-

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Names

[ CAS No. ]:
52939-62-5

[ Name ]:
1,6-HEPTADIEN-4-OL, 4-ETHYL-

[Synonym ]:
4-Aethyl-hepta-1,6-dien-4-ol
Ethyldiallylcarbinol
4-ethyl-hepta-1,6-dien-4-ol
1,6-HEPTADIEN-4-OL,4-ETHYL
4-Ethyl-1,6-heptadien-4-ol
Aethyl-diallyl-carbinol

Chemical & Physical Properties

[ Density]:
0.85g/cm3

[ Boiling Point ]:
202ºC at 760 mmHg

[ Molecular Formula ]:
C9H16O

[ Molecular Weight ]:
140.22300

[ Flash Point ]:
76.7ºC

[ Exact Mass ]:
140.12000

[ PSA ]:
20.23000

[ LogP ]:
2.27970

[ Index of Refraction ]:
1.454

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MI5460000
CHEMICAL NAME :
1,6-Heptadien-4-ol, 4-ethyl-
CAS REGISTRY NUMBER :
52939-62-5
BEILSTEIN REFERENCE NO. :
1743575
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C9-H16-O

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
LDTU** "Narkoseversuche mit Hoheren Alkoholen und Stickstoffderivaten, Dissertation," Leube, F., Pharmakologischen Institut der Universitat Tubingen, Fed. Rep. Ger., 1931 Volume(issue)/page/year: -,-,1931
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Rectal
SPECIES OBSERVED :
Rodent - guinea pig
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
LDTU** "Narkoseversuche mit Hoheren Alkoholen und Stickstoffderivaten, Dissertation," Leube, F., Pharmakologischen Institut der Universitat Tubingen, Fed. Rep. Ger., 1931 Volume(issue)/page/year: -,-,1931

Synthetic Route

Precursor & DownStream

Precursor

  • n-Ethyl propanoate
  • allyl bromide
  • Propanoyl chloride
  • ALLYL CHLORIDE
  • tris(prop-2-enyl)alumane
  • bromozinc(1+),prop-1-ene
  • Allyl(bromo)magnesium
  • allyl iodide
  • Propionic anhydride
  • 3-Chloropropanoyl chloride

DownStream

  • 3-hydroxy-3-ethylglutaric acid

Related Compounds

  • 1,6-Heptadien-4-ol,4-methyl-
  • 1,6-Heptadien-4-ol,4-propyl-
  • 4-ethenyl-1,6-heptadien-4-ol
  • 4-(1'-methylpropyl)-1,6-heptadien-4-ol
  • 4-(2'-methylpropyl)-1,6-heptadien-4-ol
  • 4-(1-Amino-2-phenylethyl)-1,6-heptadien-4-ol