Heptane, 3-methylene-

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Names

[ CAS No. ]:
1632-16-2

[ Name ]:
Heptane, 3-methylene-

[Synonym ]:
EINECS 216-636-9
3-methylideneheptane
2-ETHYL-1-HEXENE

Chemical & Physical Properties

[ Density]:
0.722 g/cm3

[ Boiling Point ]:
117.672°C

[ Molecular Formula ]:
C8H16

[ Molecular Weight ]:
112.21300

[ Flash Point ]:
10.352ºC

[ Exact Mass ]:
112.12500

[ LogP ]:
3.14280

[ Vapour Pressure ]:
20.6mmHg at 25°C

[ Index of Refraction ]:
1.411

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MP6825000
CHEMICAL NAME :
1-Hexene, 2-ethyl-
CAS REGISTRY NUMBER :
1632-16-2
BEILSTEIN REFERENCE NO. :
1733407
LAST UPDATED :
199701
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C8-H16
MOLECULAR WEIGHT :
112.24
WISWESSER LINE NOTATION :
4Y2&U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,14,1986
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,14,1986 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
4000 ppm/4H
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JIHTAB Journal of Industrial Hygiene and Toxicology. (Cambridge, MA) V.18-31, 1936-49. For publisher information, see AEHLAU. Volume(issue)/page/year: 31,343,1949
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689

Safety Information

[ Hazard Codes ]:
F

[ Risk Phrases ]:
11

[ Safety Phrases ]:
3/7-9-16-33

[ RIDADR ]:
1216

[ RTECS ]:
MP6825000

[ Packaging Group ]:
III

[ Hazard Class ]:
3

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1-Butene
  • 1-hexene
  • DIETHYLALUMINUM CHLORIDE
  • 2-Ethylhexyl bromide
  • DBU
  • Benzenesulfonic acid, 2-ethylhexyl ester
  • 3-Heptanol, 3-methyl-
  • Triethylaluminum
  • 2-Ethylhexanol
  • 2-ethylhexyl p-toluenesulfonate

DownStream

  • 2-ethylhexane-1,2-diol
  • 3-Heptanol
  • 3-Heptanol, 3-methyl-
  • 2-(1-Hydroxyethyl)-hex-1-en
  • 3-methylideneheptan-4-ol
  • 2-ethylidenehexan-1-ol
  • 2-butyl-2-ethyloxirane
  • 2-ethyl-1-hexen-3-one
  • acetic acid,hex-1-en-2-ol
  • 3-Heptanone

Related Compounds

  • ac1l3kwl
  • 1H-Imidazo[4,5-f]quinoxaline,2-ethyl-(9CI)
  • Heptane,3,3'-[thiobis(methylene)]bis- (9CI)
  • Heptane,3-[(ethenyloxy)methyl]-
  • Heptane,3-ethyl-5-methyl-
  • heptane-3,4-dione
  • Ethyl (1S,2S)-2-[[(S)-1-phenylethyl]amino]cyclopentanecarboxylate Hydrochloride
  • 7,7-Dimethyloctahydropyrazino[2,1-c][1,4]oxazine
  • 3-[(Dimethylamino)methyl]pentanoic acid
  • 1-[2-(Morpholin-4-yl)ethyl]cyclopropan-1-amine
  • 1-Methyl-4-oxa-1,9-diazaspiro[5.5]undecane
  • 2-Amino-1-(1,3-thiazol-5-yl)butan-1-one
  • 3-Amino-1-(1,3-thiazol-4-yl)butan-2-one
  • 4-Amino-1-(1,3-thiazol-5-YL)butan-1-one
  • 4-Amino-1-(1,3-thiazol-4-YL)butan-1-one
  • 5-Bromo-2-fluoro-4-hydroxybenzenesulfonyl chloride
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