Tri-tert-butyl borate
Product Information
Molecular Formula
[(CH3)3CO]3B
Molecular Weight
230.15
Description
Tri-tert-butyl borate is an indispensable reagent employed in the synthesis of diverse biomedicinal compounds. It exhibits an exceptional configuration rendering it exceptionally suitable for fabricating boron-infused pharmaceuticals. The latter, exhibiting encouraging prospects in combatting select malignancies, notably prostate and breast cancer, owe their efficacy to the aforementioned substance's invaluable contributions. Furthermore, Tri-tert-butyl borate serves as a crucial catalyst in generating pharmaceutical intermediates, thus facilitating the innovation of pioneering therapeutic interventions targeting an array of pathological conditions.
Synonyms
Boron tert-butoxide, Tri-tert-butoxyborane
IUPAC Name
tritert-butyl borate
SMILES
B(OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C
InChI
InChI=1S/C12H27BO3/c1-10(2,3)14-13(15-11(4,5)6)16-12(7,8)9/h1-9H3
InChI Key
ZMCWFMOZBTXGKI-UHFFFAOYSA-N
Boiling Point
101 °C/74 mmHg (lit.)
Melting Point
18-19 °C (lit.)
Flash Point
84.2 °F - closed cup
Purity
98%
Density
0.811 g/mL at 25 °C (lit.)
Refractive Index
n20/D 1.389 (lit.)
Safety Information
Hazards
H226
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
6
Exact Mass
230.2053249 g/mol
Monoisotopic Mass
230.2053249 g/mol
Topological Polar Surface Area
27.7Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
170
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-114149460-A | Preparation method of 3,4, 5-trifluoro-benzene boric acid | 2021-12-21 |
| CN-113831383-A | Preparation method of abiraterone | 2021-11-03 |
| CN-114100895-A | Carbon electrode cooling and anti-oxidation treatment integrated control system and method | 2021-10-28 |
| CN-113773475-A | Catalyst containing bithiophene structure and application thereof in ring-opening polymerization of cyclic ester under light control | 2021-10-14 |
| CN-113025201-A | High-temperature-resistant inorganic hybrid silicone resin metal anticorrosive paint and preparation method and application thereof | 2021-03-16 |
| CN-113025212-A | Stainless steel tackifier and preparation method and application thereof | 2021-03-13 |
| CN-112980167-A | Degradable agricultural mulching film and preparation method thereof | 2021-02-26 |
| CN-113004665-A | Antibacterial insect-preventing degradable agricultural mulching film and preparation method thereof | 2021-02-26 |
| CN-112442058-A | Preparation method of pentafluorophenylboronic acid | 2020-12-04 |
| CN-114122259-A | Perovskite thin-film solar cell and preparation method thereof | 2020-08-29 |
