HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 98221Erstellt: 26. Oktober 2026
p-Brombenzhydrylalkohol
P-BROMOBENZHYDROL · 4-Bromobenzhydrol · Benzhydrol, 4-bromo- · (+/-)-4-BROMOBENZHYDROL · 4-Bromodiphenylmethanol · 4-Bromobenzhydryl alcohol · p-bromobenzhydryl alcohol · Diphenhydramine Impurity 7
https://huagongshe.com/de/chemical/98221
Identifikatoren & physikalische Daten
| CAS No. | 29334-16-5 |
|---|
| Summenformel | C13H11BrO |
|---|
| Durchschnittliche Molmasse | 263,13 g/mol |
|---|
| Monoisotopische Masse | 261,99932707 g/mol |
|---|
| SMILES | OC(c1ccccc1)c1ccc(Br)cc1 |
|---|
| InChIKey | WTIWDBNPPSHSCB-UHFFFAOYSA-N |
|---|
| PubChem CID | 98221 |
|---|
| EC No. | 249-568-3 |
|---|
| DTXSID | DTXSID001305142 |
|---|
| Lokaler Name | p-Brombenzhydrylalkohol |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 3,4 |
|---|
| Polarare Oberfläche (TPSA) | 20,2 |
|---|
| H-Brücken-Donoren | 1 |
|---|
| H-Brücken-Akzeptoren | 1 |
|---|
| Frei drehbare Bindungen | 2 |
|---|
| Schwere Atome | 15 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 181 |
|---|
| Schmelzpunkt | 61 °C |
|---|
| Siedepunkt | 381.5±27.0 °C(Predicted) |
|---|
| Dichte | 1.435±0.06 g/cm3(Predicted) |
|---|
| Lagerbedingungen | 2-8°C |
|---|
| Löslichkeit | soluble in Methanol |
|---|
| Aggregatzustand | powder to crystal |
|---|
| pKa (Säurekonstante) | 13.34±0.20(Predicted) |
|---|
| Farbe | White to Light yellow to Light orange |
|---|
| CAS Datenbank | 29334-16-5(CAS DataBase Reference) |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
|---|
| UN-Transportnummer | 3077 |
|---|
| Zollcode | 2906290090 |
|---|
| R-Sätze (R) | 37/38-41-51/53 |
|---|
| Gefahrensymbole | Xi |
|---|
| Sicherheitshinweise (S) | 26-36 |
|---|
| Gefahrenklasse | IRRITANT |
|---|
