6-Carboxypyridine-3-boronic Acid - CAS 913836-11-0
Catalog: |
BB040154 |
Product Name: |
6-Carboxypyridine-3-boronic Acid |
CAS: |
913836-11-0 |
Synonyms: |
5-borono-2-pyridinecarboxylic acid; 5-boronopyridine-2-carboxylic acid |
IUPAC Name: | 5-boronopyridine-2-carboxylic acid |
Description: | 6-Carboxypyridine-3-boronic Acid (CAS# 913836-11-0) is a useful research chemical. |
Molecular Weight: | 166.93 |
Molecular Formula: | C6H6NO4B |
Canonical SMILES: | B(C1=CN=C(C=C1)C(=O)O)(O)O |
InChI: | InChI=1S/C6H6BNO4/c9-6(10)5-2-1-4(3-8-5)7(11)12/h1-3,11-12H,(H,9,10) |
InChI Key: | UEKWXZLQKGKCEQ-UHFFFAOYSA-N |
Boiling Point: | 454.4 °C at 760 mmHg |
Density: | 1.5 g/cm3 |
Appearance: | White solid |
LogP: | -1.54040 |
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 |
WO-2021126970-A1 | Sequential targeting in crosslinking nano-theranostics for treating brain tumors | 20191217 |
WO-2021126989-A1 | Two-way magnetic resonance tuning nanoprobe enhanced subtraction imaging | 20191217 |
CN-109721621-B | Preparation method of sialic acid recognition conductive polymer precursor | 20181230 |
JP-WO2020045342-A1 | Pretreatment reagents and nanoparticle analysis and recovery methods | 20180828 |
WO-2019004482-A1 | Heterocyclic boronic acid derivative | 20170626 |
Complexity: | 175 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 167.0389878 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 167.0389878 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 90.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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