3-Amino-2-methylpyridine

HCID 572616

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Grundinformationen

CAS: 3430-10-2
Standard-SMILES: Cc1ncccc1N
InChIKey: ZSFPJJJRNUZCEV-UHFFFAOYSA-N
Summenformel: C6H8N2
Durchschnittliche Molmasse: 108,14 g/mol
Monoisotopische Masse: 108,06874826

Überblick

structure in first source

Namen und Bezeichner

Bevorzugter Name: 3-Amino-2-methylpyridine
IUPAC: 2-methylpyridin-3-amine
Englischer Name: 3-Amino-2-picoline
Summenformel: C6H8N2
Molmasse: 108.14

Namen und Synonyme

3-Amino-2-methylpyridine3430-10-2DTXSID40341368RefChem:497064DTXCID60292449625-828-52-methylpyridin-3-amine3-Amino-2-picoline2-Methyl-3-pyridinamine3-Pyridinamine, 2-methyl-2-methyl-pyridin-3-ylamineMFCD03788195

Weitere Namen anzeigen

3-Amino-2-picolin2-Methyl-3-Aminoyridine3-AMINO-2-PICOLINE 99+%2-Methylpyridine-3-amine

2-methyl-3-pyridinylamine3-AMINOPICOLINE2-methyl-3-aminopyridine2-methyl-3-pyridylamine3-amino-2-methyl-pyridine2-Methyl-3-pyridinamine #SCHEMBL268392SCHEMBL293431

Datenbank-Bezeichner

CAS: 3430-10-2
PubChem CID: 572616
DTXSID: DTXSID40341368
EC Number: 625-828-5
Nikkaji: J80.731A

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,6
Polarare Oberfläche (TPSA): 38,9 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 0
Schwere Atome: 8
Formalladung: 0
Komplexität: 72,9

Physikochemische Eigenschaften

Schmelzpunkt: 114 · 114-119 °C
Siedepunkt: 236.8 · 236.8±20.0 °C(Predicted)
Dichte: 1.068 · 1.068±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
Löslichkeit: soluble in Methanol
pka: 6.89 · 6.89±0.10(Predicted)
Aggregatzustand: Powder or Crystalline Powder
Farbe: White to tan
InChI: 1S/C6H8N2/c1-5-6(7)3-2-4-8-5/h2-4H,7H2,1H3
InChIKey: ZSFPJJJRNUZCEV-UHFFFAOYSA-N
SMILES: Cc1ncccc1N
CAS Datenbank: 3430 · 3430-10-2(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H302 (89.4%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, 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 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 (89.4%)

Sicherheitsdaten

wgk: 3
ridadr: UN2811
hs_code: 29333990
risk_code: 22-37/38-41-36/37/38-34
hazard_code: Xi,T,Xn,C
safety_code: 26-36/39-45-36/37/39-36-27
hazard_class: 6.1
packing_group: III
Speicherklasse: 11 - Combustible Solids
Hazard Classifications: Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3

Chemie und Industrie

Anwendungen

Verwenden3-Amino-2-picoline serves as a precursor for the synthesis of 3-nitro-2-picoline via diazonium replacement of the amino group, and can itself be prepared by reduction with a 37% yield[1].