HuagongsheHuagongshe Chemistry Print Report · For research reference only
1,1,2-Trifluorobut-1-ene
1,1,2-TRIFLUOROBUTENE-1 · 1,1,2-TRIFLUOROBUT-1-ENE · 1,1,2-Trifluoro-1-butene · 1-Butene, 1,1,2-trifluoro- · 1,1,2-Trifluorobut-1-ene97% · 1,1,2-Trifluorobut-1-ene 97%
Identifiers & Physical Properties
| CAS No. | 383-84-6 |
|---|---|
| Molecular formula | C4H5F3 |
| Average molar mass | 110.08 g/mol |
| Monoisotopic mass | 110.03433465 g/mol |
| SMILES | CCC(F)=C(F)F |
| InChIKey | DZWYKNVXBDJJHP-UHFFFAOYSA-N |
| PubChem CID | 2777074 |
| DTXSID | DTXSID30380362 |
Chemical & Physical Properties
| XLogP | 1.8 |
|---|---|
| Topological polar surface area | 0 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 1 |
| Heavy atoms | 7 |
| Formal charge | 0 |
| Complexity | 80.9 |
| Boiling point | 13 °C |
| Density | 1.057±0.06 g/cm3(Predicted) |
| GHS pictogram | GHS07 |
| Signal word | Warning |
| GHS hazard statements | H315-H319-H335-H221-H280 |
| GHS precautionary statements | P271-P261-P210 |
| Hazard symbols | Xi |
| Risk statements (R) | 11 |
| Safety statements (S) | 16-23-33 |
| UN transport number | 3161 |
| Hazard Note | Irritant |
| Customs code | 2903590090 |
Safety & Regulations
| UN transport number | 3161 |
|---|---|
| Customs code | 2903590090 |
| Risk statements (R) | 11 |
| Signal word | Warning |
| GHS pictogram | GHS07 |
| Hazard symbols | Xi |
| hazard_note | Irritant |
| Safety statements (S) | 16-23-33 |
| GHS hazard statements | H315-H319-H335-H221-H280 |
| GHS precautionary statements | P271-P261-P210 |