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329746

Sigma-Aldrich

Octyl isocyanate

97%

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About This Item

Fórmula linear:
CH3(CH2)7NCO
Número CAS:
3158-26-7
Peso molecular:
155.24
Número CE:
221-598-1
Número MDL:
MFCD00013887
Código UNSPSC:
12352100
ID de substância PubChem:
24859810
NACRES:
NA.22

Nível de qualidade

100

Ensaio

97%

Formulário

liquid

índice de refração

n20/D 1.432 (lit.)

p.e.

200-204 °C (lit.)

densidade

0.88 g/mL at 25 °C (lit.)

grupo funcional

amine
isocyanate

cadeia de caracteres SMILES

CCCCCCCCN=C=O

InChI

1S/C9H17NO/c1-2-3-4-5-6-7-8-10-9-11/h2-8H2,1H3

chave InChI

DYQFCTCUULUMTQ-UHFFFAOYSA-N

Categorias relacionadas

Descrição geral

Octyl isocyanate was reported to inactivate serine proteinase, chymotrypsin.

Aplicação

Octyl isocyanate was used to suppress side reactions such as backbiting or chain transfer reaction during polymerization reactions. It was also used in the synthesis of:
  • low molar mass organogelator containing 2-(2′-hydroxyphenyl)benzoxazole (HPB) unit with long alkyl chain
  • N-octylurea
  • N-cyclopropyl-N′-octylurea

Pictogramas

Health hazardExclamation mark
GHS08,GHS07

Palavra indicadora

Danger

Classificações de perigo

Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3

Órgãos-alvo

Respiratory system

Código de classe de armazenamento

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

Classe de risco de água (WGK)

WGK 3

Ponto de fulgor (°F)

159.8 °F - closed cup

Ponto de fulgor (°C)

71 °C - closed cup

Equipamento de proteção individual

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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Certificados de análise (COA)

Lot/Batch Number
MKCQ1486
MKCP5106
MKCN8797
MKCN3864
MKCN2231

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Sigma-Aldrich

189278

p-Toluenesulfonyl isocyanate

C Morisseau et al.
Chemical research in toxicology, 14(4), 409-415 (2001-04-17)
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 this enzyme in relation to several diseases, such as emphysema, spontaneous abortion, and
W E Brown et al.
Science (New York, N.Y.), 174(4009), 608-610 (1971-11-05)
Alkyl isocyanates react specifically with the two serine proteinases, chymotrypsin and elastase, to yield inactive enzyme derivatives containing 1 male of reagent per mole of enzyme. Octyl isocyanate inactivates chymotrypsin only, while butyl isocyanate inactivates both enzymes but shows greater
Tae Hyeon Kim et al.
Journal of nanoscience and nanotechnology, 10(10), 6929-6933 (2010-12-09)
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 new chelate-based organogelator 1-Zn(II) was prepared with the reaction of
Anionic polymerization of isocyanates with optical functionalities.
Shin YD, et al.
Polymer, 42(19), 7979-7985 (2001)
Isocyanate binding to yeast glutathione reductase measured by fluorescence spectroscopy.
K J Baylor et al.
Biochemical Society transactions, 25(1), 47S-47S (1997-02-01)

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