6-Methoxy-2-methylpyridine-3-boronic Acid - CAS 459856-12-3
Catalog: |
BB026048 |
Product Name: |
6-Methoxy-2-methylpyridine-3-boronic Acid |
CAS: |
459856-12-3 |
Synonyms: |
(6-methoxy-2-methyl-3-pyridinyl)boronic acid; (6-methoxy-2-methylpyridin-3-yl)boronic acid |
IUPAC Name: | (6-methoxy-2-methylpyridin-3-yl)boronic acid |
Description: | 6-Methoxy-2-methylpyridine-3-boronic Acid (CAS# 459856-12-3) is a useful research chemical. |
Molecular Weight: | 166.97 |
Molecular Formula: | C7H10NO3B |
Canonical SMILES: | B(C1=C(N=C(C=C1)OC)C)(O)O |
InChI: | InChI=1S/C7H10BNO3/c1-5-6(8(10)11)3-4-7(9-5)12-2/h3-4,10-11H,1-2H3 |
InChI Key: | CWXWIICBKIHZFC-UHFFFAOYSA-N |
Boiling Point: | 318.9 °C at 760 mmHg |
Density: | 1.2 g/cm3 |
LogP: | -0.92160 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-10195178-B2 | GPR40 agonists in anti-diabetic drug combinations | 20160411 |
US-2017290800-A1 | Gpr40 agonists in anti-diabetic drug combinations | 20160411 |
WO-2017180457-A1 | Gpr40 agonists in anti-diabetic drug combinations | 20160411 |
EP-3294739-A1 | Tricyclic compounds as anticancer agents | 20150512 |
EP-3294739-B1 | Tricyclic compounds as anticancer agents | 20150512 |
Complexity: | 145 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 167.0753733 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 167.0753733 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 62.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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