2-PHENYL-1,3,2-DIOXABORINANE
Product Information
Molecular Formula
C9H11BO2
Molecular Weight
161.99
Description
Due to its unique structural composition, 2-PHENYL-1,3,2-DIOXABORINANE has become a key intermediate to solve tumor pathology, inflammation and neurological diseases.
Synonyms
2-PHENYL-1,3,2-DIOXABORINANE; Phenylboronic acid 1,3-propanediol ester, 99%; 2-Phenyl-1,3,2-dioxaborinane, Phenyl boronic acid glycol ester; 2-Phenyl-1,3-dioxa-2-boracyclohexane; 2-Phenyl-2-bora-1,3-dioxane; 2-Phenyl-5,6-dihydro-4H-1,3,2-dioxaborin; 2-Phe
IUPAC Name
2-phenyl-1,3,2-dioxaborinane
SMILES
B1(OCCCO1)C2=CC=CC=C2
InChI
InChI=1S/C9H11BO2/c1-2-5-9(6-3-1)10-11-7-4-8-12-10/h1-3,5-6H,4,7-8H2
InChI Key
QLWMDSAMEIJLQB-UHFFFAOYSA-N
Boiling Point
106 °C/2 mmHg (lit.)
Flash Point
235.4 °F - closed cup
Purity
95%
Density
1.077
Refractive Index
n20/D 1.528 (lit.)
Safety Information
Hazards
H315 - H319 - H335
Precautionary Statement
P302 + P352 - P305 + P351 + P338
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
162.0852098 g/mol
Monoisotopic Mass
162.0852098 g/mol
Topological Polar Surface Area
18.5Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
129
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 |
|---|---|---|
| EP-3725784-A1 | Functionalized alpha-angelica lactone monomers and polymers obtained therefrom | 2019-04-16 |
| WO-2020212041-A1 | FUNCTIONALIZED α-ANGELICA LACTONE MONOMERS AND POLYMERS OBTAINED THEREFROM | 2019-04-16 |
| US-2022033370-A1 | Functionalized a- angelica lactone monomers and polymers obtained therefrom | 2019-04-16 |
| WO-2019118476-A1 | Processes for isolation and recovery of c5 sugars | 2017-12-11 |
| BR-112020011690-A2 | processes for isolating and recovering c5 sugars | 2017-12-11 |
| CA-3084665-A1 | Processes for isolation and recovery of c5 sugars | 2017-12-11 |
| EP-3710603-A1 | Processes for isolation and recovery of c5 sugars | 2017-12-11 |
| US-2021071273-A1 | Processes for isolation and recovery of c5 sugars | 2017-12-11 |
| KR-20200037309-A | Photosensitive resin composition, dry film, cured product, printed wiring board, semiconductor element and electronic component | 2017-07-31 |
| WO-2019026772-A1 | PHOTOSENSITIVE RESIN COMPOSITION, DRY FILM, CURED PRODUCT, CIRCUIT BOARD, SEMICONDUCTOR ELEMENT, AND ELECTRONIC COMPONENT | 2017-07-31 |
