4-Formylphenylboronic acid pinacol ester

HCID 2769536

Grundinformationen

CAS
128376-64-7
Standard-SMILES
CC1(C)OB(c2ccc(C=O)cc2)OC1(C)C
InChIKey
DMBMXJJGPXADPO-UHFFFAOYSA-N
Summenformel
C13H17BO3
Durchschnittliche Molmasse
232,09 g/mol
Monoisotopische Masse
232,1270746

Namen und Bezeichner

Bevorzugter Name
4-Formylphenylboronic acid pinacol ester
IUPAC
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
Englischer Name
4-Formylphenylboronic acid pinacol cyclic ester
Summenformel
C13H17BO3
Molmasse
232.08

Namen und Synonyme

4-Formylphenylboronic acid pinacol esterRefChem:523549675-003-9128376-64-74-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde4-formylphenylboronic acid pinacol cyclic ester4-Formylphenylboronic acid, pinacol esterBenzaldehyde, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-formylphenylboronic acid pinacolateMFCD049723754-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-benzaldehydeBM087, 4-Formylphenylboronic acid pinacol ester, 128376-64-7
Weitere Namen anzeigen
)-benzaLAKOS BRN-11334-(4,4,5,5-tetramethyL4-Formylbenzeneboronic acid, pinacol ester4-Formylphenylboronic acid picol cyclic ester4-Formylbenzeneboronic acid, pinacol ester 98%4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-
DMBMXJJGPXADPO-UHFFFAOYSA-N(4-FORMYLPHENYL)BORONIC ACID PINACOL ESTERSCHEMBL2358054-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehydeSCHEMBL19877864DTXSID503777542-(4-Formylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneAKOS004115212

Datenbank-Bezeichner

CAS
128376-64-7
PubChem CID
2769536
DTXSID
DTXSID50377754
EC Number
675-003-9
Nikkaji
J845.352G

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA)
35,5 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
2
Schwere Atome
17

Physikochemische Eigenschaften

Schmelzpunkt
55 · 55-58°C
Siedepunkt
341.3 · 341.3±25.0 °C(Predicted)
Dichte
1.06 · 1.06±0.1 g/cm3(Predicted)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
Aggregatzustand
Crystalline Solid
Farbe
Off-white

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (66.7%): 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, 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 6 reports by companies from 5 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. 4 (33.3%);Acute Tox. 4 (33.3%);Skin Irrit. 2 (66.7%);Eye Irrit. 2A (66.7%);Acute Tox. 4 (33.3%);STOT SE 3 (66.7%)

Sicherheitsdaten

wgk
3
tsca
No
hs_code
2931900090
risk_code
36/37/38-43
hazard_code
Xi
hazard_note
Irritant

Chemie und Industrie

Anwendungen

VerwendenA boronic acid benzaldehyde compound for proteomics research.

Anbieter100 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]

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