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Key Documents

250767

Sigma-Aldrich

Trichloromethyl isocyanate

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About This Item

Linear Formula:
CCl3NCO
CAS Number:
Molecular Weight:
160.39
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:

Quality Level

refractive index

n20/D 1.477 (lit.)

bp

119-123 °C (lit.)

density

1.564 g/mL at 25 °C (lit.)

SMILES string

ClC(Cl)(Cl)N=C=O

InChI

1S/C2Cl3NO/c3-2(4,5)6-1-7

InChI key

OXBFBRZWBIXFGO-UHFFFAOYSA-N

Application

Reactant involved in synthesis of:
  • Trisubstituted alkanoates or lactone derivatives
  • Urea and thiourea derivatives of 15-membered azalides for use as antimalarial chemotherapeutics
Trichloromethyl isocyanate has been used in derivatization of carboxy end functional poly(methylmethacrylate) or amino end function polystyrene (polymers).

signalword

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Eye Dam. 1 - Resp. Sens. 1 - Skin Corr. 1B - Skin Sens. 1

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk_germany

WGK 3

ppe

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


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Advances in RAFT polymerization: the synthesis of polymers with defined end-groups.
Moad G, et al.
Polymer, 46(19), 8458-8468 (2005)

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