Phenol, 6-amino-2,4-dichloro-3-ethyl-, hydrochloride (1:1)
Grundinformationen
- CAS
101819-99-2- Standard-SMILES
CCc1c(Cl)cc(N)c(O)c1Cl.Cl- InChIKey
XZZITYVICUAZNB-UHFFFAOYSA-N- Summenformel
- C8H10Cl3NO
- Durchschnittliche Molmasse
- 242,5 g/mol
- Monoisotopische Masse
- 240,982797
Namen und Bezeichner
- Bevorzugter Name
- Phenol, 6-amino-2,4-dichloro-3-ethyl-, hydrochloride (1:1)
- IUPAC
- 6-amino-2,4-dichloro-3-ethylphenol;hydrochloride
- Englischer Name
- 2,4-Dichloro-3-ethyl-6-aminophenol hydrochloride
- Summenformel
- C8H10Cl3NO
- Molmasse
- 242.5301
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
101819-99-2- PubChem CID
- 13651322
- DTXSID
DTXSID3073006- EC Number
- 677-110-6
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 46,3 Ų
- H-Brücken-Donoren
- 3
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 13
- Formalladung
- 0
- Komplexität
- 156
Physikochemische Eigenschaften
- storage temp.
- RT, stored under nitrogen
- Löslichkeit
- soluble in Methanol
- Aggregatzustand
- powder to crystal
- Farbe
- Light yellow to Brown to Dark green
- InChI
- InChI=1S/C8H9Cl2NO.ClH/c1-2-4-5(9)3-6(11)8(12)7(4)10;/h3,12H,2,11H2,1H3;1H
- InChIKey
- XZZITYVICUAZNB-UHFFFAOYSA-N
- SMILES
- C1(CC)C(Cl)=CC(N)=C(O)C=1Cl.Cl
- CAS Datenbank
- 101819 · 101819-99-2(CAS DataBase Reference)
- EPA chemische Informationen
- 6 · Phenol, 6-amino-2,4-dichloro-3-ethyl-, hydrochloride (101819-99-2)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Regulatorische Informationen
Sicherheitsdaten
- wgk
- WGK 3
- tsca
- TSCA listed
- hs_code
- 2922.29.8190
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
Verwenden2,4-Dichloro-3-ethyl-6-aminophenol hydrochloride is a polyfunctional organic salt compound featuring chlorine, amino, ethyl and phenolic hydroxyl functional groups on its benzene ring structure. It can be used as a starting material or intermediate component in organic synthesis for the preparation of other compounds such as aromatic amides.
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