Dichloroacetyl isocyanate (CHEM072525)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-04 06:55:30 UTC | ||||||||
| Update Date | 2026-04-04 06:55:30 UTC | ||||||||
| Accession Number | CHEM072525 | ||||||||
| Identification | |||||||||
| Common Name | Dichloroacetyl isocyanate | ||||||||
| Class | Small Molecule | ||||||||
| Description | Dichloroacetyl isocyanate belongs to the isocyanates, a subclass of organonitrogen compounds within the organic compounds. It has the chemical formula C3H1Cl2N1O2 and an average molecular weight of 153.95 g/mol. This substance is further classified as an organic nitrogen compound. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C3H1Cl2N1O2 | ||||||||
| Average Molecular Mass | 153.950 g/mol | ||||||||
| Monoisotopic Mass | 152.938 g/mol | ||||||||
| CAS Registry Number | 6077-65-2 | ||||||||
| IUPAC Name | 2,2-dichloroacetyl isocyanate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | ClC(Cl)C(=O)N=C=O | ||||||||
| InChI Identifier | InChI=1S/C3HCl2NO2/c4-2(5)3(8)6-1-7/h2H | ||||||||
| InChI Key | TVPVPCIFAVVLAU-UHFFFAOYSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
