Allyl Isocyanate

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Names

[ CAS No. ]:
1476-23-9

[ Name ]:
Allyl Isocyanate

[Synonym ]:
1-Propene, 3-isocyanato-
3-Isocyanatoprop-1-ene
Allyl Isocyanate
3-Isocyanato-1-propene
MFCD00002044

Chemical & Physical Properties

[ Density]:
0.9±0.1 g/cm3

[ Boiling Point ]:
88.0±0.0 °C at 760 mmHg

[ Molecular Formula ]:
C4H5NO

[ Molecular Weight ]:
83.089

[ Flash Point ]:
43.3±0.0 °C

[ Exact Mass ]:
83.037117

[ PSA ]:
29.43000

[ LogP ]:
1.66

[ Appearance of Characters ]:
yellow

[ Vapour Pressure ]:
62.3±0.1 mmHg at 25°C

[ Index of Refraction ]:
1.421

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NQ8175000
CHEMICAL NAME :
Isocyanic acid, allyl ester
CAS REGISTRY NUMBER :
1476-23-9
BEILSTEIN REFERENCE NO. :
0506106
LAST UPDATED :
199710
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C4-H5-N-O
MOLECULAR WEIGHT :
83.10
WISWESSER LINE NOTATION :
OCN2U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
18 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#03769

Safety Information

[ Symbol ]:

GHS02, GHS06, GHS08

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H226-H301 + H311 + H331-H315-H317-H319-H334

[ Precautionary Statements ]:
P261-P280-P301 + P310-P305 + P351 + P338-P311

[ Personal Protective Equipment ]:
Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xn,T

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S23-S26-S36/37/39-S45

[ RIDADR ]:
UN 3080 6.1/PG 2

[ WGK Germany ]:
3

[ RTECS ]:
NQ8175000

[ Packaging Group ]:
III

[ Hazard Class ]:
3

[ HS Code ]:
2929109000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Carbamicacid, N-2-propen-1-yl-, methyl ester
  • allylurea
  • trimethylsilyl N-prop-2-enylcarbamate
  • Allylamine
  • Diphosgene
  • Benzyl chloroformate
  • Triallyl isocyanurate
  • allyl-carbamic acid-(2-hydroxy-phenyl ester)
  • allyl iodide

DownStream

  • benzyl allylcarbamate
  • Carbamicacid, N-2-propen-1-yl-, methyl ester
  • tri-n-butylisocyanatotin
  • allylurea
  • Triallyl isocyanurate
  • Acetamide,2-chloro-N-2-propen-1-yl-
  • N-Allylmethylamine
  • Allylamine
  • Dichloro(3-isocyanatopropyl)methylsilane
  • 1,3-Diallylurea

Customs

[ HS Code ]: 2929109000

[ Summary ]:
2929109000. other isocyanates. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Articles

Kinetics of the gas-phase reactions of OH and NO(3) radicals and O(3) with allyl alcohol and allyl isocyanate.

J. Phys. Chem. A 113(36) , 9814-24, (2009)

Rate constants for the gas-phase reactions of OH radical, NO(3) radical, and ozone with allyl alcohol (AAL) and allyl isocyanate (AIC) have been measured using relative rate methods at atmospheric pre...

Synthesis, characterization of dextran hydrogels and their in vitro release of gentamycin sulphate.

J. Appl. Biomater. Funct. Mater. 13 , e228-33, (2015)

This study reports on the synthesis and characterization of biodegradable dextran-allyl isocyanate-ethylamine (Dex-AE)/polyethylene glycol-diacrylate (PEGDA) hydrogels for the controlled release of ge...

European J. Org. Chem. , 2649, (2006)


More Articles

Related Compounds

  • Allyl Octadecyl Methylsilane
  • ALLYL OXYCARBONYLMETHYLENE TRIPHENYLPHOSPHORANE
  • Allyl propyl disulfide
  • ALLYL-(4-CHLORO-PHTHALAZIN-1-YL)-AMINE
  • allyl 2-cyano-2-phenylpropanoate
  • Allyl Phenyl Ether-d5
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • (5S)-5-{[(3-Pyridinylmethyl)amino]methyl}-2-pyrrolidinone dihydrochloride
  • N-(3-chlorophenyl)-5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}furan-2-carboxamide
  • tert-Butyl-DL-alanine