4'-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)acetanilide
Grundinformationen
- CAS
214360-60-8- Standard-SMILES
CC(=O)Nc1ccc(B2OC(C)(C)C(C)(C)O2)cc1- InChIKey
ANGKVUVZQVUVJO-UHFFFAOYSA-N- Summenformel
- C14H20BNO3
- Durchschnittliche Molmasse
- 261,13 g/mol
- Monoisotopische Masse
- 261,1536237
Namen und Bezeichner
- Bevorzugter Name
- 4'-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)acetanilide
- IUPAC
- N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide
- Englischer Name
- 4'-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)acetanilide
- Summenformel
- C14H20BNO3
- Molmasse
- 261.12
Namen und Synonyme
4'-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)acetanilideRefChem:505900625-791-5214360-60-8N-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetamideN-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide4-Acetamidophenylboronic acid pinacol esterMFCD020937224-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)acetanilide4-ACETYLAMINOPHENYLBORONIC ACID PINACOL ESTERN-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamideSY025526
Weitere Namen anzeigen
2-dioxaborolan-2-yl)acetanilide4-ACETAMIDOPHENYLBORONIC ACID, PINACOL ESTER4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-Y4-ACETAMIDOPHENYLBORONIC ACID, PINACOL CYCLIC ESTER4-ACETYLAMINOPHENYLBORONIC ACID PINACOL CYCLIC ESTER2-(4-ACETAMIDOPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
4-(Acetamido)benzeneboronic acid, pinacol ester4-Acetylaminophenylboronic acid, pinacol esterAM8035144-Acetamidobenzeneboronic acid pinacol esterACETAMIDE, N-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]-(4-ACETAMIDOPHENYL)BORONIC ACID PINACOL ESTERSCHEMBL1284377DTXSID80370399
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 47,6 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 19
- Formalladung
- 0
- Komplexität
- 333
Physikochemische Eigenschaften
- Schmelzpunkt
- 160 · 160-164 °C(lit.)
- Siedepunkt
- 423.2 · 423.2±28.0 °C(Predicted)
- Dichte
- 1.07 · 1.07±0.1 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- Wasserlöslichkeit
- Insoluble in water
- pka
- 15.26 · 15.26±0.70(Predicted)
- Aggregatzustand
- Powder
- Farbe
- white
- InChI
- 1S/C14H20BNO3/c1-10(17)16-12-8-6-11(7-9-12)15-18-13(2,3)14(4,5)19-15/h6-9H,1-5H3,(H,16,17)
- InChIKey
- ANGKVUVZQVUVJO-UHFFFAOYSA-N
- SMILES
- CC(=O)Nc1ccc(cc1)B2OC(C)(C)C(C)(C)O2
- CAS Datenbank
- 214360 · 214360-60-8(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (97.6%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (95.2%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 42 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 CategoriesSkin Irrit. 2 (97.6%)；Eye Irrit. 2 (97.6%)；STOT SE 3 (95.2%)
Sicherheitsdaten
- wgk
- 3
- tsca
- No
- hs_code
- 29349990
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Anbieter84 Anbieter
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州德元凯化工有限公司17837139533 · [email protected]
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