3-Methyl-3-butenenitrile

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Names

[ CAS No. ]:
4786-19-0

[ Name ]:
3-Methyl-3-butenenitrile

[Synonym ]:
3-Methylbut-3-enenitrile
3-Methyl-but-3-ennitril
3-Butenenitrile, 3-methyl-
3-methyl-but-3-enenitrile
3-Methyl-3-butenonitrile
3-Methyl-3-butenenitrile
methallyl cyanide
3-Butenenitrile,3-methyl

Chemical & Physical Properties

[ Density]:
0.8±0.1 g/cm3

[ Boiling Point ]:
126.0±9.0 °C at 760 mmHg

[ Molecular Formula ]:
C5H7N

[ Molecular Weight ]:
81.116

[ Flash Point ]:
37.3±3.8 °C

[ Exact Mass ]:
81.057846

[ PSA ]:
23.79000

[ LogP ]:
0.95

[ Vapour Pressure ]:
11.9±0.2 mmHg at 25°C

[ Index of Refraction ]:
1.412

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EM8400000
CHEMICAL NAME :
3-Butenenitrile, 3-methyl-
CAS REGISTRY NUMBER :
4786-19-0
BEILSTEIN REFERENCE NO. :
0506092
LAST UPDATED :
199612
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C5-H7-N
MOLECULAR WEIGHT :
81.13
WISWESSER LINE NOTATION :
NC1Y1&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: -,901,1986
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: -,901,1986 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
540 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 23,95,1962
TYPE OF TEST :
LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1000 ppm/4H
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 23,95,1962
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
2830 uL/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 23,95,1962

Synthetic Route


Related Compounds

  • (R)-2-HYDROXY-3-METHYL-3-BUTENENITRILE
  • 3-methyl-3-azoniabicyclo[2.2.2]octan-5-ol,chloride
  • 3-methyl-3-prop-2-enyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione
  • 3-Methyl-3-(4-methylpiperidino)propyl=benzoate
  • 3-methyl-3-silyloxybutanal
  • 3-methyl-3-propan-2-yldioxirane