2-Benzyloxy-5-formylphenylboronic acid - CAS 1310384-22-5
Catalog: |
BB073514 |
Product Name: |
2-Benzyloxy-5-formylphenylboronic acid |
CAS: |
1310384-22-5 |
Synonyms: |
2-BENZYLOXY-5-FORMYLPHENYLBORONIC ACID; (5-formyl-2-phenylmethoxyphenyl)boronic acid; (2-(benzyloxy)-5-formylphenyl)boronic acid; [2-(Benzyloxy)-5-formylphenyl]boronic acid |
IUPAC Name: | (5-formyl-2-phenylmethoxyphenyl)boronic acid |
Description: | 2-Benzyloxy-5-formylphenylboronic acid |
Molecular Weight: | 256.06 |
Molecular Formula: | C14H13BO4 |
Canonical SMILES: | B(C1=C(C=CC(=C1)C=O)OCC2=CC=CC=C2)(O)O |
InChI: | InChI=1S/C14H13BO4/c16-9-12-6-7-14(13(8-12)15(17)18)19-10-11-4-2-1-3-5-11/h1-9,17-18H,10H2 |
InChI Key: | HNCABRWZPCRMMA-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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