2-Amino-5-chloro-6-methylpyridine

HCID 12251007CAS 36936-23-9

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Grundinformationen

Standard-SMILES: Cc1nc(N)ccc1Cl
InChIKey: SHIKRPPKGCWKJO-UHFFFAOYSA-N
Summenformel: C6H7ClN2
Durchschnittliche Molmasse: 142,58 g/mol
Monoisotopische Masse: 142,0297759

Namen und Bezeichner

Bevorzugter Name: 2-Amino-5-chloro-6-methylpyridine
IUPAC: 5-chloro-6-methylpyridin-2-amine
Englischer Name: 2-Amino-5-chloro-6-picoline
Summenformel: C6H7ClN2
Molmasse: 142.59

Namen und Synonyme

2-AMINO-5-CHLORO-6-METHYLPYRIDINERefChem:464558803-766-15-chloro-6-methylpyridin-2-amine36936-23-95-CHLORO-6-METHYL-2-PYRIDINAMINEMFCD094533356-Amino-3-chloropicoline2-Amino-5-chloro-6-picoline2-Pyridinamine, 5-chloro-6-methyl-2-Amino-5-Chloro-6-Methyl PyridineSCHEMBL558598

Weitere Namen anzeigen

6-Amino-3-chloropicolline2-AMINO 5-CHLORO PICOLINE2-Amino-5-chloro-6-methylpyridi6-Amino-3-chloro-2-methylpyridine5-Chloro-6-methyl-2-aminopyridine

6-Amino-3-chloro-2-picoline5-chloro-6-methyl-pyridineamineDTXSID50482438SHIKRPPKGCWKJO-UHFFFAOYSA-N5-chloro-6-methyl-pyridin-2-amineSTL119698AKOS000108170AB50593

Datenbank-Bezeichner

CAS: 36936-23-9
PubChem CID: 12251007
DTXSID: DTXSID50482438
EC Number: 803-766-1

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,5
Polarare Oberfläche (TPSA): 38,9 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 0
Schwere Atome: 9
Formalladung: 0
Komplexität: 97

Physikochemische Eigenschaften

Schmelzpunkt: 70 · 70-75℃
Siedepunkt: 234.2 · 234.2±35.0 °C(Predicted)
Dichte: 1.26 · 1.260±0.06 g/cm3(Predicted)
storage temp.: 2 · Keep in dark place,Inert atmosphere,2-8°C
Aggregatzustand: powder to crystal
pka: 4.83 · 4.83±0.37(Predicted)
Farbe: White to Orange to Green
InChI: InChI=1S/C6H7ClN2/c1-4-5(7)2-3-6(8)9-4/h2-3H,1H3,(H2,8,9)
InChIKey: SHIKRPPKGCWKJO-UHFFFAOYSA-N
SMILES: C1(N)=NC(C)=C(Cl)C=C1

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral]；H318 (97.6%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 2 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.