2,6-Bis(bromomethyl)pyridine

HCID 603610CAS 7703-74-4

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Grundinformationen

Standard-SMILES: BrCc1cccc(CBr)n1
InChIKey: QUTSYCOAZVHGGT-UHFFFAOYSA-N
Summenformel: C7H7Br2N
Durchschnittliche Molmasse: 264,94 g/mol
Monoisotopische Masse: 262,89452342

Namen und Bezeichner

Bevorzugter Name: 2,6-Bis(bromomethyl)pyridine
IUPAC: 2,6-bis(bromomethyl)pyridine
Englischer Name: 2,6-Bis(bromomethyl)pyridine
Summenformel: C7H7Br2N
Molmasse: 264.95

Namen und Synonyme

2,6-Bis(bromomethyl)pyridine7703-74-4DTXSID70345314RefChem:445219DTXCID80296388628-946-5MFCD00191795Pyridine, 2,6-bis(bromomethyl)-2,6-Di(bromomethyl)pyridine2,6-Bis(bromomethyl)pyridine #alpha,alpha'-dibromo-2,6-lutidineAS-40739

Weitere Namen anzeigen

SKL6502,6-Bis(bromoethyl)pyridine2,6-Bis(broMoMethyl)pyridine 98%2,6-Bis(bromomethyl)pyridine >alpha,alpha'-Dibromo-2,6-lutidine2,6-BIS(BROMOMETHYL)PYRIDINE ISO 9001：2015 REACH

SY053771EN300-194164AM8043442,6-Bis(bromomethyl)pyridA846454SCHEMBL245158ALBB-023566SBB071671

Datenbank-Bezeichner

CAS: 7703-74-4
PubChem CID: 603610
DTXSID: DTXSID70345314
EC Number: 628-946-5
Nikkaji: J752.400E

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2
Polarare Oberfläche (TPSA): 12,9 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 2
Schwere Atome: 10
Formalladung: 0
Komplexität: 87,6

Physikochemische Eigenschaften

Schmelzpunkt: 85 · 85-87 °C(lit.)
Siedepunkt: 275.6 · 275.6±30.0 °C(Predicted)
Dichte: 1.87 · 1.870±0.06 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
Aggregatzustand: powder to crystaline
pka: 1.65 · 1.65±0.24(Predicted)
Farbe: White to Almost white
InChI: InChI=1S/C7H7Br2N/c8-4-6-2-1-3-7(5-9)10-6/h1-3H,4-5H2
InChIKey: QUTSYCOAZVHGGT-UHFFFAOYSA-N
SMILES: C1(CBr)=NC(CBr)=CC=C1

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (97.6%)

Sicherheitsdaten

wgk: 3
ridadr: UN 3335
hs_code: 29333990
risk_code: 22-36/37/38
hazard_code: Xn
safety_code: 26-36/37/39
Speicherklasse: 11 - Combustible Solids
Hazard Classifications: Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3

Chemie und Industrie

Anwendungen · 1 Eintrag

Verwenden2,6-Bis(bromomethyl)pyridine may be used in the preparation of the following:a new pyridine-pyrazole derivative, 2,6-bis(3,5-diphenylpyrazol-1-ylmethyl)pyridinea large macrocyclic ligand, N(1),N(7)-pyridine-2,6-dimethyl-N(2),N(6)-bis(6-(3-(1H-benzo[d]imidazol-1-yl)propanamido)pyridin-2-yl)pyridine-2,6-dicarboxamide dibromidesmall-ring, potentially tridentate Se(2)N(pyridyl)-donor macrocycles