3-Amino-6-chloro-2-picoline

HCID 7009500

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Grundinformationen

CAS: 164666-68-6
Standard-SMILES: Cc1nc(Cl)ccc1N
InChIKey: QVCIIOZINFCMDJ-UHFFFAOYSA-N
Summenformel: C6H7ClN2
Durchschnittliche Molmasse: 142,58 g/mol
Monoisotopische Masse: 142,0297759

Namen und Bezeichner

Bevorzugter Name: 3-Amino-6-chloro-2-picoline
IUPAC: 6-chloro-2-methylpyridin-3-amine
Englischer Name: 3-Amino-6-chloro-2-picoline
Summenformel: C6H7ClN2
Molmasse: 142.59

Namen und Synonyme

164666-68-63-Amino-6-chloro-2-picolineDTXSID50426559RefChem:276574DTXCID30377393676-221-76-chloro-2-methylpyridin-3-amine3-amino-6-chloro-2-methylpyridine5-amino-2-chloro-6-methylpyridine3-PYRIDINAMINE, 6-CHLORO-2-METHYL-MFCD030952205-amino-2-chloro-6-picoline

Weitere Namen anzeigen

2-CHLORO-4-METHYLPYRIDIN-3-AMINE3-AMINO-2-CHLORO-4-METHYLPYRIDINETIMTEC-BB SBB010194ASINEX-REAG BAS 137949172-CHLORO-5-AMINO-6-PICOLINE

6-CHLORO-2-METHYL-PYRIDIN-3-YLAMINE6-chloro-2-methyl-pyridin-3-amine6-CHLORO-2-METHYL-3-PYRIDINAMINESCHEMBL1128266QVCIIOZINFCMDJ-UHFFFAOYSA-N6-chloro-2-methyl-3-pyridylamineCS-D09723-amino-6-chloro-2-methyl pyridine

Datenbank-Bezeichner

CAS: 164666-68-6
PubChem CID: 7009500
DTXSID: DTXSID50426559
EC Number: 676-221-7

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: 93 · 93-94℃
Siedepunkt: 232.49 °C · 232.49°C (rough estimate)
Dichte: 1.2124 · 1.2124 (rough estimate)
Brechungsindex: 1.4877 · 1.4877 (estimate)
storage temp.: -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
pka: 1.79 · 1.79±0.10(Predicted)
Aggregatzustand: Solid
Farbe: Pale yellow
CAS Datenbank: 164666 · 164666-68-6(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 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.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (50%)

Sicherheitsdaten

ridadr: 2811
hs_code: 29333990
risk_code: 22-37/38-41-20/21/22
hazard_code: Xi,T,Xn
safety_code: 26-39-36/37-24/25
hazard_class: IRRITANT, TOXIC

Chemie und Industrie

Anwendungen

Verwenden6-Chloro-2-methylpyridin-3-amine has been used as a reactant in the preparation of Pyrido[3,2-e][1,4]diazepine derivatives with anti-HIV-1-activity.