Benzenamine, 2-chloro-N-methyl-

HCID 136736CAS 932-32-1

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Grundinformationen

Standard-SMILES: CNc1ccccc1Cl
InChIKey: WGNNILPYHCKCFF-UHFFFAOYSA-N
Summenformel: C7H8ClN
Durchschnittliche Molmasse: 141,6 g/mol
Monoisotopische Masse: 141,03452694

Namen und Bezeichner

Bevorzugter Name: Benzenamine, 2-chloro-N-methyl-
IUPAC: 2-chloro-N-methylaniline
Englischer Name: 2-CHLORO-N-METHYLANILINE
Summenformel: C7H8ClN
Molmasse: 141.6

Namen und Synonyme

2-Chloro-N-methylaniline932-32-1Benzenamine, 2-chloro-N-methyl-DTXSID50239323RefChem:561688DTXCID70161814624-653-1N-Methyl-2-chloroanilineMFCD000451702-Chloro-N-methylbenzenamine2-chloro-N-methyl-aniline2-chlor-n-methylaniline

Weitere Namen anzeigen

N-Methyl-o-chloroanilineo-Chloro-N-methylanilineN1-METHYL-2-CHLOROANILINE2-Chloro-N-methylbenzylamineo-Chloro-N-methylbenzenamine2-(Methylamino)chlorobenzene2-Chloro-N-methylaniline ,97%

2-chloro-N-methyl anilineSCHEMBL100946(2-chloro-phenyl)-methyl-amineSY048562C3121CS-0095956EN300-12541052-chloranyl-N-methyl-aniline

Datenbank-Bezeichner

CAS: 932-32-1
PubChem CID: 136736
DTXSID: DTXSID50239323
EC Number: 624-653-1
Nikkaji: J364.607F

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,5
Polarare Oberfläche (TPSA): 12 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 1
Schwere Atome: 9
Formalladung: 0
Komplexität: 85

Experimentelle und physikochemische Eigenschaften

SpringerMaterials PropertiesOptical coefficient

Physikochemische Eigenschaften

Siedepunkt: 218 °C · 218 °C (lit.)
Dichte: 1.15 g/mL · 1.15 g/mL at 25 °C (lit.)
Brechungsindex: 20 · n20/D 1.579(lit.)
Flammpunkt: 198 °F · 198 °F
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
Löslichkeit: Not miscible or difficult to mix.
pka: 3.17 · 3.17±0.10(Predicted)
Aggregatzustand: clear liquid
Farbe: Colorless to Red to Green
BRN: 2802444 · 2802444
InChI: 1S/C7H8ClN/c1-9-7-5-3-2-4-6(7)8/h2-5,9H,1H3
InChIKey: WGNNILPYHCKCFF-UHFFFAOYSA-N
SMILES: CNc1ccccc1Cl
CAS Datenbank: 932 · 932-32-1(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (12.8%): 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)

Aggregated GHS information provided per 47 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (12.8%)

Sicherheitsdaten

wgk: 3
ridadr: 2810
hs_code: 29214200
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
hazard_class: 6.1
packing_group: III
Speicherklasse: 10 - Combustible liquids
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3

Chemie und Industrie

Anwendungen

Verwenden2-Chloro-N-methylaniline is used to produce 1-methyl-2-thioacetylpyrrole in the presence of reagent Lawesson's reagent and solvent tetrahydrofuran.