Hept-1-in
Bezeichnung:Hept-1-in
CAS-Nr628-71-7
Englisch Name:1-Heptyne
CBNumberCB3171402
SummenformelC7H12
Molgewicht96.17
MOL-Datei628-71-7.mol
Synonyma
Hept-1-in
Hept-1-in physikalisch-chemischer Eigenschaften
| Schmelzpunkt | -81 °C (lit.) |
| Siedepunkt | 99-100 °C (lit.) |
| Dichte | 0.733 g/mL at 25 °C (lit.) |
| Dampfdruck | 93.1 mm Hg ( 37.7 °C) |
| Brechungsindex | n |
| Flammpunkt | 28 °F |
| storage temp. | Flammables area |
| Aggregatzustand | Liquid |
| Farbe | Clear colorless to light yellow-green |
| Wasserlöslichkeit | Soluble in organic solvents. Insoluble in water. |
| BRN | 1733518 |
| Henry's Law Constant | 1.8×10-4 mol/(m3Pa) at 25℃, Brockbank (2013) |
| InChI | 1S/C7H12/c1-3-5-7-6-4-2/h1H,4-7H2,2H3 |
| InChIKey | YVXHZKKCZYLQOP-UHFFFAOYSA-N |
| SMILES | CCCCCC#C |
| LogP | 3.208 (est) |
| CAS Datenbank | 628-71-7(CAS DataBase Reference) |
| NIST chemische Informationen | 1-Heptyne(628-71-7) |
| Kennzeichnung gefährlicher | F,Xn |
| R-Sätze: | 11-36/37/38-65 |
| S-Sätze: | 16-26-36-62-9-33 |
| RIDADR | UN 3295 3/PG 2 |
| WGK Germany | 3 |
| F | 10-23 |
| TSCA | TSCA listed |
| HazardClass | 3 |
| PackingGroup | II |
| HS Code | 29012980 |
| Speicherklasse | 3 - Flammable liquids |
| Hazard Classifications | Flam. Liq. 2 |
