3-Bromo-4-methylpyridin-2-ol

HCID 13463813

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Grundinformationen

CAS: 18368-59-7
Standard-SMILES: Cc1cc[nH]c(=O)c1Br
InChIKey: DDRFLSCTQJTMAA-UHFFFAOYSA-N
Summenformel: C6H6BrNO
Durchschnittliche Molmasse: 188,02 g/mol
Monoisotopische Masse: 186,96328

Namen und Bezeichner

Bevorzugter Name: 3-Bromo-4-methylpyridin-2-ol
IUPAC: 3-bromo-4-methyl-1H-pyridin-2-one
Englischer Name: 2-Hydroxy-3-bromo-4-methylpyridine
Summenformel: C6H6BrNO
Molmasse: 188.02

Namen und Synonyme

3-bromo-4-methylpyridin-2-olRefChem:498707869-629-318368-59-72-HYDROXY-3-BROMO-4-METHYLPYRIDINE3-Bromo-4-methylpyridin-2(1H)-one3-Bromo-4-methyl-2-(1H)-pyridinone3-Bromo-2-hydroxy-4-methylpyridine3-BROMO-4-METHYL-1H-PYRIDIN-2-ONE3-Bromo-2-hydroxy-4-picolineMFCD098397083-BROMO-4-METHYL-1,2-DIHYDROPYRIDIN-2-ONE

Weitere Namen anzeigen

2-HYDROXY-3-BROMO-4-PICOLINE3-BROMO-4-METHYL-2(1H)-PYRIDINONE

MFCD021810712(1H)-Pyridinone, 3-bromo-4-methyl-2(1H)-Pyridin3-bromo-4-methyl-2-pyridoneSCHEMBL1262367SCHEMBL146626323-Bromo-4-methyl-pyridin-2-olDTXSID50541473

Datenbank-Bezeichner

CAS: 18368-59-7
PubChem CID: 13463813
DTXSID: DTXSID50541473
EC Number: 869-629-3

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1
Polarare Oberfläche (TPSA): 29,1 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 0
Schwere Atome: 9
Formalladung: 0
Komplexität: 205

Physikochemische Eigenschaften

Siedepunkt: 323.2 · 323.2±42.0 °C(Predicted)
Dichte: 1.622 · 1.622±0.06 g/cm3(Predicted)
storage temp.: Sealed in dry,Room Temperature
pka: 10.56 · 10.56±0.10(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): 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, 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 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.