5-(Benzyloxy)-2-formylphenylboronic Acid - CAS 1226773-36-9
Catalog: |
BB073654 |
Product Name: |
5-(Benzyloxy)-2-formylphenylboronic Acid |
CAS: |
1226773-36-9 |
Synonyms: |
B-[2-Formyl-5-(phenylmethoxy)phenyl]boronic Acid |
IUPAC Name: | (2-formyl-5-phenylmethoxyphenyl)boronic acid |
Description: | 5-(Benzyloxy)-2-formylphenylboronic Acid |
Molecular Weight: | 256.06 |
Molecular Formula: | C14H13BO4 |
Canonical SMILES: | B(C1=C(C=CC(=C1)OCC2=CC=CC=C2)C=O)(O)O |
InChI: | InChI=1S/C14H13BO4/c16-9-12-6-7-13(8-14(12)15(17)18)19-10-11-4-2-1-3-5-11/h1-9,17-18H,10H2 |
InChI Key: | FEFDHTIODOFOKS-UHFFFAOYSA-N |
Complexity: | 279 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 256.0906891 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 256.0906891 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 66.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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