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

Modify Date: 2024-01-09 09:48:24

1,6-HEPTADIEN-4-OL, 4-ETHYL- Structure
1,6-HEPTADIEN-4-OL, 4-ETHYL- structure
 Common Name 1,6-HEPTADIEN-4-OL, 4-ETHYL-
CAS Number 52939-62-5 Molecular Weight 140.22300
Density 0.85g/cm3 Boiling Point 202ºC at 760 mmHg
Molecular Formula C9H16O Melting Point N/A
MSDS N/A Flash Point 76.7ºC

 Names

Name 4-ethylhepta-1,6-dien-4-ol
Synonym More Synonyms

 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

n-Ethyl propanoate structure

n-Ethyl propanoate

CAS#:105-37-3
allyl bromide structure

allyl bromide

CAS#:106-95-6

~86%

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

1,6-HEPTADIEN-4...

CAS#:52939-62-5
Literature: Jia, Yu; Zhang, Mingfu; Tao, Fenggang; Zhou, Jingyao Synthetic Communications, 2002 , vol. 32, # 18 p. 2829 - 2835
Propanoyl chloride structure

Propanoyl chloride

CAS#:79-03-8
ALLYL CHLORIDE structure

ALLYL CHLORIDE

CAS#:107-05-1

~64%

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

1,6-HEPTADIEN-4...

CAS#:52939-62-5
Literature: Ishino, Yoshio; Mihara, Masatoshi; Kageyama, Manabu Tetrahedron Letters, 2002 , vol. 43, # 37 p. 6601 - 6604
Propanoyl chloride structure

Propanoyl chloride

CAS#:79-03-8
tris(prop-2-enyl)alumane structure

tris(prop-2-eny...

CAS#:18854-66-5

~98%

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

1,6-HEPTADIEN-4...

CAS#:52939-62-5
Literature: Shen, Kao-Hsien; Kuo, Chun-Wei; Yao, Ching-Fa Tetrahedron Letters, 2007 , vol. 48, # 36 p. 6348 - 6351
bromozinc(1+),prop-1-ene structure

bromozinc(1+),p...

CAS#:18925-10-5
Propanoyl chloride structure

Propanoyl chloride

CAS#:79-03-8

~71%

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

1,6-HEPTADIEN-4...

CAS#:52939-62-5
Literature: Wei, Yu-Juan; Ren, Heng; Wang, Jin-Xian Tetrahedron Letters, 2008 , vol. 49, # 39 p. 5697 - 5699
n-Ethyl propanoate structure

n-Ethyl propanoate

CAS#:105-37-3
Allyl(bromo)magnesium structure

Allyl(bromo)mag...

CAS#:1730-25-2

~%

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

1,6-HEPTADIEN-4...

CAS#:52939-62-5
Literature: Henze; Allen; Leslie Journal of Organic Chemistry, 1942 , vol. 7, p. 333
allyl iodide structure

allyl iodide

CAS#:556-56-9
n-Ethyl propanoate structure

n-Ethyl propanoate

CAS#:105-37-3

~%

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

1,6-HEPTADIEN-4...

CAS#:52939-62-5
Literature: Smirensky Journal fuer Praktische Chemie (Leipzig), 1882 , vol. <2>25, p. 59
allyl iodide structure

allyl iodide

CAS#:556-56-9
Propionic anhydride structure

Propionic anhydride

CAS#:123-62-6

~%

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

1,6-HEPTADIEN-4...

CAS#:52939-62-5
Literature: Saizew,A. Journal fuer Praktische Chemie (Leipzig), 1907 , vol. <2>76, p. 100
3-Chloropropanoyl chloride structure

3-Chloropropano...

CAS#:625-36-5
Allyl(bromo)magnesium structure

Allyl(bromo)mag...

CAS#:1730-25-2

~%

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

1,6-HEPTADIEN-4...

CAS#:52939-62-5
Literature: Barluenga, Jose; Florez, Josefa; Yus, Miguel Synthesis, 1983 , # 5 p. 378 - 381

 Synonyms

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
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4-(1'-methylpropyl)-1,6-heptadien-4-ol
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71897-97-7
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