2,4,6-Triisopropylphenylboronic Acid
Product Information
Molecular Formula
C15H25O2B
Molecular Weight
248.17
Description
2,4,6-Triisopropylphenylboronic Acid (CAS# 154549-38-9) is a useful research chemical.
Synonyms
[2,4,6-tri(propan-2-yl)phenyl]boronic acid; [2,4,6-tri(propan-2-yl)phenyl]boronic acid
IUPAC Name
[2,4,6-tri(propan-2-yl)phenyl]boronic acid
SMILES
B(C1=C(C=C(C=C1C(C)C)C(C)C)C(C)C)(O)O
InChI
InChI=1S/C15H25BO2/c1-9(2)12-7-13(10(3)4)15(16(17)18)14(8-12)11(5)6/h7-11,17-18H,1-6H3
InChI Key
FGFYEKLWZBTLEW-UHFFFAOYSA-N
Boiling Point
346.8 °C at 760 mmHg
Melting Point
167-172 °C
Flash Point
Not applicable
Density
0.97 g/cm3
Storage
2-8 °C
LogP
2.73660
Safety Information
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
4
Exact Mass
248.1947602 g/mol
Monoisotopic Mass
248.1947602 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
233
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-113831319-A | Suzuki reaction method of arylboronic acid/boric acid ester containing large steric hindrance substituent | 2021-10-19 |
| CN-110483570-B | Process for preparing organic phosphine ligand compound with large steric hindrance and electron deficiency | 2019-07-24 |
| CN-109369715-B | Method for synthesizing di-tert-butylphosphine biphenyl compound | 2018-12-11 |
| JP-2019151633-A | Method for producing aromatic compound | 2018-03-05 |
| KR-20190000812-A | Organic electroluminescent materials and devices | 2017-06-23 |
| US-2018375036-A1 | Organic electroluminescent materials and devices | 2017-06-23 |
| US-2019119312-A1 | Organic electroluminescent materials and devices | 2017-06-23 |
| US-2020140471-A1 | Organic electroluminescent materials and devices | 2017-06-23 |
| JP-2018170236-A | Nonaqueous electrolyte for batteries and lithium secondary battery | 2017-03-30 |
| JP-6884020-B2 | Non-aqueous electrolyte for batteries and lithium secondary battery | 2017-03-30 |
