6-Chlor-o-toluidin
2-Chloro-6-methylaniline
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Grundinformationen
- CAS
87-63-8- Standard-SMILES
Cc1cccc(Cl)c1N- InChIKey
WFNLHDJJZSJARK-UHFFFAOYSA-N- Summenformel
- C7H8ClN
- Durchschnittliche Molmasse
- 141,6 g/mol
- Monoisotopische Masse
- 141,03452694
Namen und Bezeichner
- Bevorzugter Name
- 2-Chloro-6-methylaniline
- IUPAC
- 2-chloro-6-methylaniline
- Lokaler Name
- 6-Chlor-o-toluidin
- Englischer Name
- 2-Chloro-6-methylaniline
- Summenformel
- C7H8ClN
- Molmasse
- 141.6
Namen und Synonyme
2-Chloro-6-methylaniline6-Chloro-o-toluidine2-Amino-3-chlorotoluene6-CHLORO-2-METHYLANILINEBenzenamine, 2-chloro-6-methyl-2-Methyl-6-chloroaniline3-Chloro-2-aminotoluene6-Chloro-2-toluidine2-CHLORO-6-METHYL-ANILINEo-Toluidine, 6-chloro-6-Chloro-o-toluidine (NH2=1)EINECS 201-759-2
Weitere Namen anzeigen
6COToro-6-methyLTIMTEC-BB SBB0041536-chloro-o-toluidin2-Chloro-6-methylani6-ChIoro-o-toluidine
UNII-76F11RQ7TBNSC 60121BRN 0774624Benzenamine, 6-chloro-2-methyl-NSC-601212-chloro-6-methylbenzenamine(2-Chloro-6-methylphenyl)amineDTXSID8058956
Datenbank-Bezeichner
- CAS
87-63-8- PubChem CID
- 6897
- DTXSID
DTXSID8058956- UNII
- 76F11RQ7TB
- EC Number
- 201-759-2
- Nikkaji
- J3.539D
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 2,2
- Polarare Oberfläche (TPSA)
- 26 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 94,9
Experimentelle und physikochemische Eigenschaften
SpringerMaterials PropertiesOptical coefficient
Physikochemische Eigenschaften
- Schmelzpunkt
- 10 · 10-12 °C(lit.)
- Siedepunkt
- 215 °C · 215 °C(lit.)
- Dichte
- 1.152 g/mL · 1.152 g/mL at 25 °C(lit.)
- Brechungsindex
- 20 · n20/D 1.576(lit.)
- Flammpunkt
- 210 °F · 210 °F
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Löslichkeit
- Chloroform (Slightly), Ethyl Acetate (Slightly)
- Aggregatzustand
- Oil
- pka
- 2.51 · 2.51±0.10(Predicted)
- Farbe
- Clear Colourless to Pale Purple
- Wasserlöslichkeit
- Immiscible
- BRN
- 774624 · 774624
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H301 (16%): Toxic if swallowed [Danger Acute toxicity, oral]
P203, P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P317, P318, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 50 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
S - indicates a substance that is identified in a final Significant New Use Rule.
Status: Active Update: 09-11-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21012
Hazard Classes and CategoriesAcute Tox. 3 (16%)
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 3429 6.1/PG 3
- hs_code
- 29214300
- RTECS-Nr.
- XU5100000
- risk_code
- 36/37/38-20/21/22
- hazard_code
- Xi,Xn
- safety_code
- 26-36-36/37/39
- hazard_class
- 6.1
- packing_group
- III
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing InformationBenzenamine, 2-chloro-6-methyl-: ACTIVE
Anwendungen
Beschreibung2-chloro-6-methylaniline is an important organic synthesis intermediate widely applied to chemical pharmacy, pesticides, and organic synthesis. In the aspects of chemical pharmacy and pesticides, 2-chloro-6-methylaniline can be used as a reaction starting material to participate in the preparation processes of tyrosine kinase inhibitors dasatinib, indazole derivatives with anti-breast cancer activity, 2-methyl-6-chlorophenyl sulfonylurea derivatives with bacteriostatic activity and the like; in the aspect of organic synthesis, 2-chloro-6-methylaniline can introduce chemical groups such as hydrazine, nitro, cyano, halogen (F, Cl, Br), and the like into an aromatic ring through diazotization reaction, thereby participating in wide chemical reactions.
Verwenden2-Chloro-6-methylaniline is a substituted aniline used in the preparation of various pharmaceutical compounds. 2-Chloro-6-methylaniline showed inhibition of the polymerization of vinyl acetate.
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