Octyl isocyanate

Names

[ Name ]:
Octyl isocyanate

[Synonym ]:
Octylisocyanate
n-Octylisocyanate
EINECS 221-598-1
1-isocyanato-octane
1-n-octyl isocyanate
Octyl isocyanate
1-Octyl isocyanate
MFCD00013887
octanisocyanate
Octane,1-isocyanato

Chemical & Physical Properties

[ Density]:
0.88 g/mL at 25 °C(lit.)

[ Boiling Point ]:
200-204 °C(lit.)

[ Molecular Formula ]:
C₉H₁₇NO

[ Molecular Weight ]:
155.23700

[ Flash Point ]:
160 °F

[ Exact Mass ]:
155.13100

[ PSA ]:
29.43000

[ LogP ]:
2.68270

[ Index of Refraction ]:
n20/D 1.432(lit.)

[ Water Solubility ]:
DECOMPOSES

MSDS

Safety Information

[ Symbol ]:

GHS07, GHS08

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H302-H315-H319-H334-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338-P342 + P311

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

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R20/21/22;R36/37/38;R42

[ Safety Phrases ]:
S23-S26-S36-S45-S37/39

[ RIDADR ]:
UN 2206 6.1/PG 3

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
2929109000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Carbon dioxide
imino-octylimino-azanium
1-Iodooctane
Octylamine
1-Octanol
TETRABUTYLAMMONIUM CYANATE
1-Mercaptooctane
Tridecane
Nonanoyl chloride

DownStream

N-OCTYLUREA
Carbamic acid octyl ester
N-octylimidazole-1-carboxamide
4-nitrophenyl N-octylcarbamate
3-[6-(2,2-dicyanoethenyl)-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]-N-phenylpropanamide
1-(8-hydroxyquinolin-7-yl)-3-octylurea

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

Isocyanate binding to yeast glutathione reductase measured by fluorescence spectroscopy.

Biochem. Soc. Trans. 25(1) , 47S, (1997)

Inhibition of microsomal epoxide hydrolases by ureas, amides, and amines.

Chem. Res. Toxicol. 14(4) , 409-15, (2001)

The microsomal epoxide hydrolase (mEH) plays a significant role in the metabolism of xenobiotics such as polyaromatic toxicants. Additionally, polymorphism studies have underlined a potential role of ...

Self-assembly of supramolecualr metallogelator containing 2-(2'-hydroxyphenyl) benzoxazole/Zn(II) chelate.

J. Nanosci. Nanotechnol. 10(10) , 6929-33, (2010)

A low molar mass organogelator 1 containing 2-(2'-hydroxyphenyl)benzoxazole (HPB) unit with long alkyl chain was synthesized by the reaction with HPB and octyl isocyanate in THF at room temperature. A...