6-(2,2,2-Trifluoroethoxy)pyridine-3-boronic Acid - CAS 196083-20-2
Catalog: |
BB015178 |
Product Name: |
6-(2,2,2-Trifluoroethoxy)pyridine-3-boronic Acid |
CAS: |
196083-20-2 |
Synonyms: |
[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]boronic acid; [6-(2,2,2-trifluoroethoxy)pyridin-3-yl]boronic acid |
IUPAC Name: | [6-(2,2,2-trifluoroethoxy)pyridin-3-yl]boronic acid |
Description: | 6-(2,2,2-Trifluoroethoxy)pyridine-3-boronic Acid (CAS# 196083-20-2) is a useful research chemical compound. |
Molecular Weight: | 220.94 |
Molecular Formula: | C7H7F3NO3B |
Canonical SMILES: | B(C1=CN=C(C=C1)OCC(F)(F)F)(O)O |
InChI: | InChI=1S/C7H7BF3NO3/c9-7(10,11)4-15-6-2-1-5(3-12-6)8(13)14/h1-3,13-14H,4H2 |
InChI Key: | OGBJEQPXZICXNY-UHFFFAOYSA-N |
LogP: | -0.29750 |
GHS Hazard Statement: | 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, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021130638-A1 | Diacylglycerol kinase modulating compounds | 20191224 |
US-2021171529-A1 | Heterocyclic compounds as delta-5 desaturase inhibitors and methods of use | 20191125 |
US-2020361939-A1 | Modulators of alpha-1 antitrypsin | 20190514 |
KR-20190110736-A | Novel triazolone derivatives or its salt and pharmaceutical compositions comprising the same | 20180321 |
US-2019322655-A1 | Novel triazolone derivatives or salts thereof and pharmaceutical compositions comprising the same | 20180321 |
Complexity: | 202 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.0471077 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.0471077 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 62.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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