HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 57780902Erstellt: 1. November 2026
6-chloro-N-(3-(trifluoromethyl)phenyl)pyrimidin-4-amine
6-Chloro-N-[3-(trifluoromethyl)-phenyl]pyrimidin-4-amine · 4-Pyrimidinamine, 6-chloro-N-[3-(trifluoromethyl)phenyl]-
https://huagongshe.com/de/chemical/57780902
Identifikatoren & physikalische Daten
| CAS No. | 872510-82-2 |
|---|
| Summenformel | C11H7ClF3N3 |
|---|
| Durchschnittliche Molmasse | 273,64 g/mol |
|---|
| Monoisotopische Masse | 273,0280594 g/mol |
|---|
| SMILES | FC(F)(F)c1cccc(Nc2cc(Cl)ncn2)c1 |
|---|
| InChIKey | PWQVXSLCVWMYTA-UHFFFAOYSA-N |
|---|
| PubChem CID | 57780902 |
|---|
| EC No. | 806-784-8 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 3,9 |
|---|
| Polarare Oberfläche (TPSA) | 37,8 |
|---|
| H-Brücken-Donoren | 1 |
|---|
| H-Brücken-Akzeptoren | 6 |
|---|
| Frei drehbare Bindungen | 2 |
|---|
| Schwere Atome | 18 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 275 |
|---|
| Siedepunkt | 344.7±42.0 °C(Predicted) |
|---|
| Dichte | 1.460±0.06 g/cm3(Predicted) |
|---|
| pKa (Säurekonstante) | 1.93±0.10(Predicted) |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
|---|
| Zollcode | 2933399990 |
|---|
