5-Isopropoxypyridine-3-boronic Acid Pinacol Ester - CAS 1171892-42-4
Catalog: |
BB003864 |
Product Name: |
5-Isopropoxypyridine-3-boronic Acid Pinacol Ester |
CAS: |
1171892-42-4 |
Synonyms: |
3-propan-2-yloxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine; 3-propan-2-yloxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
IUPAC Name: | 3-propan-2-yloxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
Description: | 5-Isopropoxypyridine-3-boronic Acid Pinacol Ester (CAS# 1171892-42-4) is a useful research chemical. |
Molecular Weight: | 263.14 |
Molecular Formula: | C14H22NO3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC(=CN=C2)OC(C)C |
InChI: | InChI=1S/C14H22BNO3/c1-10(2)17-12-7-11(8-16-9-12)15-18-13(3,4)14(5,6)19-15/h7-10H,1-6H3 |
InChI Key: | DPMKLRJKZXEWSN-UHFFFAOYSA-N |
LogP: | 2.16800 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2010255727-A1 | 1H-imidazo[4,5-c]quinolinone derivatives | 20090604 |
AU-2010255727-B2 | 1H-imidazo[4,5-c]quinolinone derivatives | 20090604 |
EA-020715-B1 | DERIVATIVES 1H-IMIDAZO [4,5-c] QUINOLINONA | 20090604 |
EP-2438063-A1 | 1h-imidazo[4,5-c]quinolinone compounds, useful for the treatment of proliferative diseases | 20090604 |
JP-2012528828-A | 1H-imidazo [4,5-c] quinolinone derivative | 20090604 |
Complexity: | 304 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 263.1692737 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 263.1692737 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 40.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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