4-[(Tetrahydropyran-2-yl)oxy]phenylboronic Acid - CAS 182281-01-2
Catalog: |
BB013904 |
Product Name: |
4-[(Tetrahydropyran-2-yl)oxy]phenylboronic Acid |
CAS: |
182281-01-2 |
Synonyms: |
[4-(2-oxanyloxy)phenyl]boronic acid; [4-(oxan-2-yloxy)phenyl]boronic acid |
IUPAC Name: | [4-(oxan-2-yloxy)phenyl]boronic acid |
Description: | 4-[(Tetrahydropyran-2-yl)oxy]phenylboronic Acid (CAS# 182281-01-2) is a reagent in the synthesis diclhoroacetamide analogs displaying high anti-cancer avtivity. Also used in the synthesis of organic semiconductors. |
Molecular Weight: | 222.05 |
Molecular Formula: | C11H15O4B |
Canonical SMILES: | B(C1=CC=C(C=C1)OC2CCCCO2)(O)O |
InChI: | InChI=1S/C11H15BO4/c13-12(14)9-4-6-10(7-5-9)16-11-3-1-2-8-15-11/h4-7,11,13-14H,1-3,8H2 |
InChI Key: | DMGMCZRNMYQQQB-UHFFFAOYSA-N |
Boiling Point: | 411.3 ℃ at 760 mmHg |
Density: | 1.21 g/cm3 |
MDL: | MFCD02183525 |
LogP: | 0.27180 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
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 |
Publication Number | Title | Priority Date |
CN-113493694-A | Compound, liquid crystal composition and liquid crystal display element | 20200401 |
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WO-2021065450-A1 | Active light sensitive or radiation sensitive resin composition, active light sensitive or radiation sensitive film, pattern forming method, and method for producing electronic device | 20190930 |
Complexity: | 204 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 222.1063391 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 222.1063391 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 58.9 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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