2-Amino-5-bromo-3-iodopyridine

HCID 1516508CAS 381233-96-1

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Grundinformationen

Standard-SMILES: Nc1ncc(Br)cc1I
InChIKey: XPERZSKJGNUSHI-UHFFFAOYSA-N
Summenformel: C5H4BrIN2
Durchschnittliche Molmasse: 298,91 g/mol
Monoisotopische Masse: 297,86026

Namen und Bezeichner

Bevorzugter Name: 2-Amino-5-bromo-3-iodopyridine
IUPAC: 5-bromo-3-iodopyridin-2-amine
Englischer Name: 2-AMINO-5-BROMO-3-IODOPYRIDINE
Summenformel: C5H4BrIN2
Molmasse: 298.91

Namen und Synonyme

381233-96-12-Amino-5-bromo-3-iodopyridineDTXSID90363974RefChem:255662DTXCID00315020622-993-55-Bromo-3-iodopyridin-2-amine2-Amino-3-iodo-5-bromopyridine5-bromo-3-iodo-pyridin-2-ylamineMFCD066590002-Pyridinamine, 5-bromo-3-iodo-SCHEMBL4618937

Weitere Namen anzeigen

5-Bromo-3-iodo-2-aminopyridine5-Bromo-3-iodo-2-pyridinamine2-PyridinaMine,5-broMo-3-iodo-2-Amino-5-bromo-3-iodopyridine 96%2-AMINO-5-BROMO-3-IODOPYRIDINE ISO 9001：2015 REACH

5-Bromo-3-iodopyridine-2-amineAKOS005257759CS-W003313AB25852AC-91262-Amino-5-bromo-3-iodopyridine, 97%5-bromo-3-iodo-pyridin-2-amine2-Amine-5-bromo-3-iodopyridine

Datenbank-Bezeichner

CAS: 381233-96-1
PubChem CID: 1516508
DTXSID: DTXSID90363974
EC Number: 622-993-5
Nikkaji: J3.270.796C

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,8
Polarare Oberfläche (TPSA): 38,9 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 0
Schwere Atome: 9
Formalladung: 0
Komplexität: 101

Physikochemische Eigenschaften

Schmelzpunkt: 111 · 111-112°C
Siedepunkt: 308.2 · 308.2±42.0 °C(Predicted)
Dichte: 2.426 · 2.426±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
Aggregatzustand: powder to crystal
pka: 2.25 · 2.25±0.49(Predicted)
Farbe: White to Yellow to Orange
InChI: InChI=1S/C5H4BrIN2/c6-3-1-4(7)5(8)9-2-3/h1-2H,(H2,8,9)
InChIKey: XPERZSKJGNUSHI-UHFFFAOYSA-N
SMILES: C1(N)=NC=C(Br)C=C1I
CAS Datenbank: 381233 · 381233-96-1(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (85.4%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (83.3%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (16.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+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 48 reports by companies from 8 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.