Grundinformationen
- Standard-SMILES
CC1(C)C=C(B2OC(C)(C)C(C)(C)O2)CC(C)(C)O1- InChIKey
VOXXPMAJNSVUKJ-UHFFFAOYSA-N- Summenformel
- C15H27BO3
- Durchschnittliche Molmasse
- 266,19 g/mol
- Monoisotopische Masse
- 266,20532512
Namen und Bezeichner
- Bevorzugter Name
- 2,2,6,6-Tetramethyl-3,6-dihydro-2H-pyran-4-boronic acid pinacol ester
- IUPAC
- 4,4,5,5-tetramethyl-2-(2,2,6,6-tetramethyl-3H-pyran-4-yl)-1,3,2-dioxaborolane
- Englischer Name
- (2,2,6,6-tetramethyl-3,6-dihydro-2H-pyran-4-yl)boronic acid, pinacol ester
- Summenformel
- C15H27BO3
- Molmasse
- 266.18
Namen und Synonyme
2,2,6,6-TETRAMETHYL-3,6-DIHYDRO-2H-PYRAN-4-BORONIC ACID PINACOL ESTERRefChem:440765696-115-41142363-56-14,4,5,5-tetramethyl-2-(2,2,6,6-tetramethyl-3,6-dihydro-2H-pyran-4-yl)-1,3,2-dioxaborolane4,4,5,5-tetramethyl-2-(2,2,6,6-tetramethyl-3H-pyran-4-yl)-1,3,2-dioxaborolane(2,2,6,6-Tetramethyl-3,6-dihydro-2H-pyran-4-yl)boronic acid, pinacol esterMFCD11044439(2,2,6,6-Tetramethyl-3,6-dihydro-2H-pyran-4-yl)boronic acid pinacol ester2H-Pyran, 3,6-dihydro-2,2,6,6-tetramethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,2,6,6-Tetramethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyranSCHEMBL3655929
Weitere Namen anzeigen
2,2,6,6-TetraMethyl-3,6-dihydro-2H-pyran-4-boronic acid pinacol ester, 97%2,2,6,6-Tetramethyl-3,6-dihydro-2H-pyran-4-boronic acid pinacol ester, 97%,
DTXSID30674157VOXXPMAJNSVUKJ-UHFFFAOYSA-NSVB36356AKOS015960329SB74473DS-14954SY239864CS-0061114
Datenbank-Bezeichner
- CAS
1142363-56-1- PubChem CID
- 46738000
- DTXSID
DTXSID30674157- EC Number
- 696-115-4
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 27,7 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 19
- Formalladung
- 0
- Komplexität
- 392
Physikochemische Eigenschaften
- Siedepunkt
- 281.9 · 281.9±50.0 °C(Predicted)
- Dichte
- 0.97 · 0.97±0.1 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- Aggregatzustand
- solid
- InChI
- InChI=1S/C15H27BO3/c1-12(2)9-11(10-13(3,4)17-12)16-18-14(5,6)15(7,8)19-16/h9H,10H2,1-8H3
- InChIKey
- VOXXPMAJNSVUKJ-UHFFFAOYSA-N
- SMILES
- C1(C)(C)OC(C)(C)C=C(B2OC(C)(C)C(C)(C)O2)C1
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- wgk
- WGK 3
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
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