259322

Chloroacetyl isocyanate

≥95%

• Linear Formula: ClCH₂CONCO
• CAS Number: 4461-30-7
• Molecular Weight: 119.51
• EC Number: 224-715-4
• MDL number: MFCD00002034
• UNSPSC Code: 12352100
• PubChem Substance ID: 24855702
• NACRES: NA.22

Properties

• Quality Level: 100
• assay: ≥95%
• form: liquid
• refractive index: n20/D 1.463 (lit.)
• bp: 50-55 °C/20 mmHg (lit.)
• density: 1.403 g/mL at 25 °C (lit.)
• functional group: amine; chloro; isocyanate
• storage temp.: −20°C
• SMILES string: ClCC(=O)N=C=O
• InChI: 1S/C3H2ClNO2/c4-1-3(7)5-2-6/h1H2
• InChI key: MOVMEFHWBOWMFU-UHFFFAOYSA-N

Description

Application

Chloroacetyl isocyanate has been used in the synthesis of:

• fumagillin analogs
• 2-chloro-N-(4-oxocyclopent-2-enyl)-acetamide

Safety Information

• pictograms: GHS06,GHS08,GHS05
• signalword: Danger
• hcodes: H301,H314,H334
• pcodes: P261 - P270 - P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 3 Oral - Resp. Sens. 1 - Skin Corr. 1B
• supp_hazards: EUH014
• Storage Class: 6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
• wgk_germany: WGK 3
• flash_point_f: 143.6 °F - closed cup
• flash_point_c: 62 °C - closed cup
• ppe: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter