6-(Benzyloxy)pyridine-3-boronic Acid - CAS 929250-35-1
Catalog: |
BB040719 |
Product Name: |
6-(Benzyloxy)pyridine-3-boronic Acid |
CAS: |
929250-35-1 |
Synonyms: |
(6-phenylmethoxy-3-pyridinyl)boronic acid; (6-phenylmethoxypyridin-3-yl)boronic acid |
IUPAC Name: | (6-phenylmethoxypyridin-3-yl)boronic acid |
Description: | 6-(Benzyloxy)pyridine-3-boronic Acid (CAS# 929250-35-1) is a useful research chemical. |
Molecular Weight: | 229.04 |
Molecular Formula: | C12H12NO3B |
Canonical SMILES: | B(C1=CN=C(C=C1)OCC2=CC=CC=C2)(O)O |
InChI: | InChI=1S/C12H12BNO3/c15-13(16)11-6-7-12(14-8-11)17-9-10-4-2-1-3-5-10/h1-8,15-16H,9H2 |
InChI Key: | CUZOGAUUSKBDAO-UHFFFAOYSA-N |
Boiling Point: | 423.4 ℃ at 760 mmHg |
Density: | 1.25 g/cm3 |
MDL: | MFCD06798262 |
LogP: | 0.34040 |
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-2019220125-A1 | Antibacterial compounds | 20180516 |
AU-2019269544-A1 | Antibacterial compounds | 20180516 |
BR-112020023155-A2 | antibacterial compounds | 20180516 |
CN-112449638-A | Antibacterial compounds | 20180516 |
EP-3793990-A1 | Antibacterial compounds | 20180516 |
Complexity: | 222 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.0910234 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.0910234 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 62.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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