1-Pyreneboronic Acid - CAS 164461-18-1
Catalog: |
BB012109 |
Product Name: |
1-Pyreneboronic Acid |
CAS: |
164461-18-1 |
Synonyms: |
1-pyrenylboronic acid; pyren-1-ylboronic acid |
IUPAC Name: | pyren-1-ylboronic acid |
Description: | 1-Pyreneboronic Acid (CAS# 164461-18-1) is a useful research chemical. |
Molecular Weight: | 246.07 |
Molecular Formula: | C16H11O2B |
Canonical SMILES: | B(C1=C2C=CC3=CC=CC4=C3C2=C(C=C1)C=C4)(O)O |
InChI: | InChI=1S/C16H11BO2/c18-17(19)14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9,18-19H |
InChI Key: | MWEKPLLMFXIZOC-UHFFFAOYSA-N |
Boiling Point: | 565.5 ± 33.0 °C (predicted) |
Melting Point: | 247-251 °C |
Flash Point: | Not applicable |
Purity: | 99 % |
Density: | 1.3 g/cm3 |
Appearance: | Pale yellow powder |
MDL: | MFCD04974062 |
LogP: | 2.26380 |
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-113149807-A | Triplet annihilator and preparation method and application thereof | 20210514 |
CN-113004194-A | Circular polarization luminescent organic micro-nano crystal material and preparation method and application thereof | 20210309 |
CN-111909103-A | Novel quinoxaline luminescent material and preparation method and application thereof | 20200730 |
CN-111592540-A | Imidazonaphthyridine high-performance photoelectric material and application thereof | 20200612 |
CN-111825683-A | Paramagnetic calix [4] porphyrin compound and preparation method thereof | 20200605 |
PMID | Publication Date | Title | Journal |
22580421 | 20120701 | Determination of glyoxylic acid in urine by liquid chromatography with fluorescence detection, using a novel derivatization procedure based on the Petasis reaction | Analytical and bioanalytical chemistry |
22412328 | 20090101 | Metal Ion Enhanced Charge Transfer in a Terpyridine-bis-Pyrene System | Sensors (Basel, Switzerland) |
Complexity: | 346 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 246.0852098 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 246.0852098 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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