4,4,5,5-Tetramethyl-2-(4-phenylthiophen-2-yl)-1,3,2-dioxaborolane
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Basic information
- CAS
960116-25-0- Standard SMILES
CC1(C)OB(c2cc(-c3ccccc3)cs2)OC1(C)C- InChIKey
YOEQUOGEMIDLFK-UHFFFAOYSA-N- Molecular formula
- C16H19BO2S
- Average molar mass
- 286.2 g/mol
Names & identifiers
- Preferred name
- 4,4,5,5-Tetramethyl-2-(4-phenylthiophen-2-yl)-1,3,2-dioxaborolane
- IUPAC
- 4,4,5,5-tetramethyl-2-(4-phenylthiophen-2-yl)-1,3,2-dioxaborolane
- English name
- 4,4,5,5-TetraMethyl-2-(4-phenyl-thiophen-2-yl)-[1,3,2]dioxaborolane
- Molecular formula
- C16H19BO2S
- Molecular weight
- 286.2
Names & synonyms
960116-25-04-Phenylthiophene-2-boronic acid pinacol ester4,4,5,5-tetramethyl-2-(4-phenylthiophen-2-yl)-1,3,2-dioxaborolaneMFCD120324804,4,5,5-tetramethyl-2-(4-phenyl-2-thienyl)-1,3,2-DioxaborolaneSCHEMBL13764298AKOS015943455DA-22088PS-12987CS-0189185E90704Reaxys ID: 15611259
Show more names
5-Phenylthiophene-2-boronic acid piancol ester1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-(4-phenyl-2-thienyl)-4,4,5,5-TetraMethyl-2-(4-phenyl-thiophen-2-yl)-[1,3,2]dioxaborolane
Database identifiers
- CAS
960116-25-0- Nikkaji
- J2.859.434H
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 46.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 336
Physicochemical properties
- Boiling point
- 390.4 · 390.4±30.0 °C(Predicted)
- Density
- 1.12 · 1.12±0.1 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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