4,4,5,5,6,6,6-Heptafluorohex-2-enoic acid (CHEM118447)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-06 05:54:13 UTC | ||||||||
| Update Date | 2026-05-21 04:56:44 UTC | ||||||||
| Accession Number | CHEM118447 | ||||||||
| Identification | |||||||||
| Common Name | 4,4,5,5,6,6,6-Heptafluorohex-2-enoic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | 4,4,5,5,6,6,6-Heptafluorohex-2-enoic acid is an organic compound with the chemical formula C6H3F7O2 and an average molecular weight of 240.08 g/mol. 4,4,5,5,6,6,6-Heptafluorohex-2-enoic acid belongs to the fatty acids and conjugates, a subclass of fatty acyls within the organic compounds. This substance is found in or released from 13 recorded sources across several sectors. In the electrical and electronic equipment sector, it is associated with cell phones, capacitors, wires and cables, batteries, and printed circuit boards, among one other source. It is found in textiles, leather and furnishings, specifically within synthetic textiles as well as carpets and rugs. Within the food, food processing and cookware sector, it is linked to food packaging, while in the healthcare, pharmaceuticals and veterinary products sector, it is associated with medical devices. Additionally, the compound is found in lubricants used in both the energy, oil and gas sector and the industrial manufacturing and chemical processing sector. It is also present in one additional sector. Recorded exposure routes for this compound include inhalation, oral, and touch. | ||||||||
| Contaminant Sources | Not Available | ||||||||
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| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C6H3F7O2 | ||||||||
| Average Molecular Mass | 240.077 g/mol | ||||||||
| Monoisotopic Mass | 240.002 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 4,4,5,5,6,6,6-Heptafluorohex-2-enoic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | OC(=O)C=CC(F)(F)C(F)(F)C(F)(F)F | ||||||||
| InChI Identifier | InChI=1S/C6H3F7O2/c7-4(8,2-1-3(14)15)5(9,10)6(11,12)13/h1-2H,(H,14,15) | ||||||||
| InChI Key | KRBNWYYINLFKND-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 | ||||||||
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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 | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
