5-Hydroxy-2-methylphenylboronic acid - CAS 1375216-45-7
Catalog: |
BB060846 |
Product Name: |
5-Hydroxy-2-methylphenylboronic acid |
CAS: |
1375216-45-7 |
Synonyms: |
5-Hydroxy-2-methylphenylboronic acid; (5-Hydroxy-2-methylphenyl)boronic acid; (5-Hydroxy-2-methylphenyl)boronicacid |
IUPAC Name: | (5-hydroxy-2-methylphenyl)boronic acid |
Description: | 5-Hydroxy-2-methylphenylboronic acid |
Molecular Weight: | 151.96 |
Molecular Formula: | C7H9BO3 |
Canonical SMILES: | B(C1=C(C=CC(=C1)O)C)(O)O |
InChI: | InChI=1S/C7H9BO3/c1-5-2-3-6(9)4-7(5)8(10)11/h2-4,9-11H,1H3 |
InChI Key: | ONNUFDZTGJBMSO-UHFFFAOYSA-N |
Complexity: | 129 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.0644743 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.0644743 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 60.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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