3-(Aminomethyl)-5-bromopyridine

HCID 22992264

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Grundinformationen

CAS: 135124-70-8
Standard-SMILES: NCc1cncc(Br)c1
InChIKey: OQUHYNMITHDQLD-UHFFFAOYSA-N
Summenformel: C6H7BrN2
Durchschnittliche Molmasse: 187,04 g/mol
Monoisotopische Masse: 185,97926

Namen und Bezeichner

Bevorzugter Name: 3-(Aminomethyl)-5-bromopyridine
IUPAC: (5-bromo-3-pyridinyl)methanamine
Englischer Name: 3-(Aminomethyl)-5-bromopyridine 97%
Summenformel: C6H7BrN2
Molmasse: 187.04

Namen und Synonyme

3-(Aminomethyl)-5-bromopyridineRefChem:494085640-639-8(5-Bromopyridin-3-yl)methanamine135124-70-8(5-Bromo-3-pyridinyl)methylamine5-Bromo-3-pyridinemethylamine1-(5-BROMOPYRIDIN-3-YL)METHANAMINEMFCD06212876(5-bromo-3-pyridyl)methylamineCHEMBL61207453-(Aminomethyl)-5-bromopyridine 97per cent

Weitere Namen anzeigen

(5-Bromopyridin-3-yl)methylamine3-(Aminomethyl)-5-bromopyridine 97%3-(Aminomethyl)-5-bromopyridine 97%3-(Aminomethyl)-5-bromopyridine 95+%(5-bromopyridin-3-yl)methanamine - [B3293]

C-(5-BROMO-PYRIDIN-3-YL)-METHYLAMINE3-Pyridinemethanamine, 5-bromo-3-Aminomethyl-5-bromopyridine5-BROMO-3-PYRIDINEMETHANAMINE5-aminomethyl-3-bromopyridineSCHEMBL745600(5-bromo-3-pyridyl)methanamineDTXSID50629407

Datenbank-Bezeichner

CAS: 135124-70-8
PubChem CID: 22992264
DTXSID: DTXSID50629407
ChEMBL: CHEMBL6120745
EC Number: 640-639-8

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,4
Polarare Oberfläche (TPSA): 38,9 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 9
Formalladung: 0
Komplexität: 87

Physikochemische Eigenschaften

Siedepunkt: 269.4 · 269.4±25.0 °C(Predicted)
Dichte: 1.574 · 1.574±0.06 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka: 7.75 · 7.75±0.29(Predicted)
Aggregatzustand: liquid
Farbe: Red

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H301 (33.3%): Toxic if swallowed [Danger Acute toxicity, oral]；H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H314 (33.3%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (33.3%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (66.7%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (33.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 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 CategoriesAcute Tox. 3 (33.3%)；Acute Tox. 4 (66.7%)；Acute Tox. 4 (33.3%)；Skin Corr. 1B (33.3%)；Eye Dam. 1 (33.3%)；Acute Tox. 4 (66.7%)