HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 11447232Erstellt: 29. Oktober 2026
N~2~-(4-Methoxyphenyl)pyridine-2,3-diamine
3-Amino-2-(4-methoxyphenyl)amino-pyridine · 2,3-Pyridinediamine, N2-(4-methoxyphenyl)-
https://huagongshe.com/de/chemical/11447232
Identifikatoren & physikalische Daten
| CAS No. | 41010-68-8 |
|---|
| Summenformel | C12H13N3O |
|---|
| Durchschnittliche Molmasse | 215,25 g/mol |
|---|
| Monoisotopische Masse | 215,10586205 g/mol |
|---|
| SMILES | COc1ccc(Nc2ncccc2N)cc1 |
|---|
| InChIKey | GAKVHRACPVAOAC-UHFFFAOYSA-N |
|---|
| PubChem CID | 11447232 |
|---|
| ChEMBL | CHEMBL3637811 |
|---|
| EC No. | 178-965-3 |
|---|
| DTXSID | DTXSID60466148 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 2 |
|---|
| Polarare Oberfläche (TPSA) | 60,2 |
|---|
| H-Brücken-Donoren | 2 |
|---|
| H-Brücken-Akzeptoren | 4 |
|---|
| Frei drehbare Bindungen | 3 |
|---|
| Schwere Atome | 16 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 204 |
|---|
| Siedepunkt | 389.8±37.0 °C(Predicted) |
|---|
| Dichte | 1.230±0.06 g/cm3(Predicted) |
|---|
| pKa (Säurekonstante) | 6.08±0.10(Predicted) |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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%) |
|---|
| Gefahrenklasse | IRRITANT |
|---|
