5-Hydroxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde

HCID 57689987

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Grundinformationen

CAS: 1038827-60-9
Standard-SMILES: CC1(C)OB(c2ccc(O)cc2C=O)OC1(C)C
InChIKey: QLKZCPHJMLNAHM-UHFFFAOYSA-N
Summenformel: C13H17BO4
Durchschnittliche Molmasse: 248,08 g/mol
Monoisotopische Masse: 248,1219892

Namen und Bezeichner

Bevorzugter Name: 5-Hydroxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
IUPAC: 5-hydroxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
Englischer Name: 5-hydroxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
Summenformel: C13H17BO4
Molmasse: 248.08

Namen und Synonyme

5-hydroxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde1038827-60-9RefChem:536175979-908-2MFCD16994390UNII-F2SLJ5AX8XF2SLJ5AX8XSCHEMBL5660775-HYDROXY-2-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-BENZALDEHYDE5-hydroxy-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehydeBENZALDEHYDE, 5-HYDROXY-2-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-SCHEMBL29756335

Weitere Namen anzeigen

QLKZCPHJMLNAHM-UHFFFAOYSA-NNRB82760AKOS027425292MB15560SY294281DB-333028CS-0089484EN300-25185569

Datenbank-Bezeichner

CAS: 1038827-60-9
PubChem CID: 57689987
UNII: F2SLJ5AX8X
EC Number: 979-908-2
Nikkaji: J3.529.482A

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 55,8 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 2
Schwere Atome: 18
Formalladung: 0
Komplexität: 313

Physikochemische Eigenschaften

storage temp.: 2 · 2-8°C, stored under nitrogen

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 1 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.