2-Chloro-5-isopropoxyphenylboronic Acid - CAS 1256346-12-9
Catalog: |
BB006156 |
Product Name: |
2-Chloro-5-isopropoxyphenylboronic Acid |
CAS: |
1256346-12-9 |
Synonyms: |
(2-chloro-5-propan-2-yloxyphenyl)boronic acid; (2-chloro-5-propan-2-yloxyphenyl)boronic acid |
IUPAC Name: | (2-chloro-5-propan-2-yloxyphenyl)boronic acid |
Description: | 2-Chloro-5-isopropoxyphenylboronic Acid (CAS# 1256346-12-9) is a useful research chemical. |
Molecular Weight: | 214.45 |
Molecular Formula: | C9H12ClO3B |
Canonical SMILES: | B(C1=C(C=CC(=C1)OC(C)C)Cl)(O)O |
InChI: | InChI=1S/C9H12BClO3/c1-6(2)14-7-3-4-9(11)8(5-7)10(12)13/h3-6,12-13H,1-2H3 |
InChI Key: | YRJUDZPRHUDUCB-UHFFFAOYSA-N |
MDL: | MFCD16295073 |
LogP: | 0.80700 |
Publication Number | Title | Priority Date |
EP-3191454-A1 | Cyclopropanecarboxylic acid gpr120 modulators | 20140909 |
EP-3191454-B1 | Cyclopropanecarboxylic acid gpr120 modulators | 20140909 |
ES-2705773-T3 | Modulators of GPR120 of cyclopropanecarboxylic acid | 20140909 |
US-2017253554-A1 | Cyclopropanecarboxylic acid gpr120 modulators | 20140909 |
US-9938222-B2 | Cyclopropanecarboxylic acid GPR120 modulators | 20140909 |
Complexity: | 177 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 214.0568021 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 214.0568021 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 49.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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