HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 11194673Generated: November 2, 2026
1-Cyclopropyl-4,4,4-trifluorobutane-1,3-dione
1-cyclopropyl-4,4,4-trifluoro-1,3-butanedione · 1,3-Butanedione, 1-cyclopropyl-4,4,4-trifluoro-
https://huagongshe.com/en/chemical/11194673
Identifiers & Physical Properties
| CAS No. | 30923-69-4 |
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| Molecular formula | C7H7F3O2 |
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| Average molar mass | 180.12 g/mol |
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| Monoisotopic mass | 180.03981395 g/mol |
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| SMILES | O=C(CC(=O)C(F)(F)F)C1CC1 |
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| InChIKey | LTTCLMXHNACGKU-UHFFFAOYSA-N |
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| PubChem CID | 11194673 |
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| EC No. | 675-366-3 |
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| DTXSID | DTXSID00458289 |
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Chemical & Physical Properties
| XLogP | 1.4 |
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| Topological polar surface area | 34.1 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 12 |
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| Formal charge | 0 |
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| Complexity | 215 |
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| Boiling point | 178.4±35.0 °C(Predicted) |
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| Density | 1.374±0.06 g/cm3(Predicted) |
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| Storage conditions | under inert gas (nitrogen or Argon) at 2-8°C |
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| pKa (acidity coefficient) | 6+-.0.20(Predicted) |
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| Appearance | Colorless to light yellow Liquid |
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| GHS pictogram | GHS07 |
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| Signal word | Warning |
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| GHS hazard statements | H302 |
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| GHS precautionary statements | P501-P270-P264-P301+P312+P330 |
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| Hazard class | IRRITANT |
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| Customs code | 2918999090 |
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Safety & Regulations
| GHS classification | WarningH227 (50%): Combustible liquid [Warning Flammable liquids]P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Flam. Liq. 4 (50%) |
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| Customs code | 2918999090 |
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| Signal word | Warning |
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| GHS pictogram | GHS07 |
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| Hazard class | IRRITANT |
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| GHS hazard statements | H302 |
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| GHS precautionary statements | P501-P270-P264-P301+P312+P330 |
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