6-Isobutoxynaphthalene-2-boronic acid - CAS 1228310-17-5
Catalog: |
BB056314 |
Product Name: |
6-Isobutoxynaphthalene-2-boronic acid |
CAS: |
1228310-17-5 |
Synonyms: |
6-(2-Methylpropoxy)-2-naphthaleneboronic acid; 6-Isobutoxynaphthalene-2-boronic acid; (6-Isobutoxynaphthalen-2-yl)boronic acid; [6-(2-methylpropoxy)naphthalen-2-yl]boronic acid; 6-Isobutoxynaphthalene-2-boronicacid |
IUPAC Name: | [6-(2-methylpropoxy)naphthalen-2-yl]boronic acid |
Description: | 6-Isobutoxynaphthalene-2-boronic acid |
Molecular Weight: | 244.09 |
Molecular Formula: | C14H17BO3 |
Canonical SMILES: | B(C1=CC2=C(C=C1)C=C(C=C2)OCC(C)C)(O)O |
InChI: | InChI=1S/C14H17BO3/c1-10(2)9-18-14-6-4-11-7-13(15(16)17)5-3-12(11)8-14/h3-8,10,16-17H,9H2,1-2H3 |
InChI Key: | LRZCWHYVQRQCFU-UHFFFAOYSA-N |
Complexity: | 257 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 244.1270746 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 244.1270746 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 49.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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