5-Phenyl-1H-tetrazol
Bezeichnung:5-Phenyl-1H-tetrazol
CAS-Nr18039-42-4
Englisch Name:5-Phenyltetrazole
CBNumberCB9703557
SummenformelC7H6N4
Molgewicht146.15
MOL-Datei18039-42-4.mol
Synonyma
5-Phenyl-1H-tetrazol
5-Phenyl-1H-tetrazol physikalisch-chemischer Eigenschaften
| Schmelzpunkt | 216 °C (dec.)(lit.) |
| Siedepunkt | 255.75°C (rough estimate) |
| Dichte | 1.2955 (rough estimate) |
| Brechungsindex | 1.6530 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| Löslichkeit | DMSO, Methanol (Slightly) |
| pka | 4.28±0.10(Predicted) |
| Aggregatzustand | Crystalline Powder |
| Farbe | White to almost white |
| InChI | InChI=1S/C7H6N4/c1-2-4-6(5-3-1)7-8-10-11-9-7/h1-5H,(H,8,9,10,11) |
| InChIKey | MARUHZGHZWCEQU-UHFFFAOYSA-N |
| SMILES | N1=C(C2=CC=CC=C2)N=NN1 |
| CAS Datenbank | 18039-42-4(CAS DataBase Reference) |
| NIST chemische Informationen | 1H-Tetrazole, 5-phenyl-(18039-42-4) |
| EPA chemische Informationen | 1H-Tetrazole, 5-phenyl- (18039-42-4) |
| Kennzeichnung gefährlicher | Xn,Xi,F |
| R-Sätze: | 22-44-11-36/37/38 |
| S-Sätze: | 36-37/39-26-16 |
| RIDADR | UN 1325 4.1/PG III |
| WGK Germany | 3 |
| RTECS-Nr. | XF7538750 |
| TSCA | Yes |
| HazardClass | IRRITANT |
| PackingGroup | III |
| HS Code | 29339900 |
| Toxizität | mouse,LD50,oral,890mg/kg (890mg/kg),BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLDLUNGS, THORAX, OR RESPIRATION: DYSPNEA,National Technical Information Service. Vol. OTS0570992, |
