| CAS Number | 1313760-73-4 |
| Catalog Number | AG01A4G6 |
| Chemical Name | [2-(3-Methylbutoxy)naphthalen-1-yl]boronic acid |
| IUPAC Name | [2-(3-methylbutoxy)naphthalen-1-yl]boronic acid |
| InChI | InChI=1S/C15H19BO3/c1-11(2)9-10-19-14-8-7-12-5-3-4-6-13(12)15(14)16(17)18/h3-8,11,17-18H,9-10H2,1-2H3 |
| InChI Key | SVZXDQRZLMYRLP-UHFFFAOYSA-N |
| MDL Number | MFCD12862844 |
| Molecular Formula | C15H19BO3 |
| Molecular Weight | 258.1206 |
| SMILES | CC(C)CCOC1=CC=C2C=CC=CC2=C1B(O)O |
| Synonyms | [2-(3-methylbutoxy)naphthalen-1-yl]boronic acid,
1313760-73-4,
SCHEMBL2562676,
AKOS010258522,
ZINC169928433,
NE61875,
|
| Complexity | 270 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 258.143g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.124g/mol |
| Monoisotopic Mass | 258.143g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 49.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number