| CAS Number | 934558-37-9 |
| Catalog Number | AG00IHMQ(AGN-PC-0WAY4F) |
| Chemical Name | 2-(2-Methoxyphenyl)-4,4,6-trimethyl-1,3,2-dioxaborinane |
| IUPAC Name | 2-(2-methoxyphenyl)-4,4,6-trimethyl-1,3,2-dioxaborinane |
| InChI | InChI=1S/C13H19BO3/c1-10-9-13(2,3)17-14(16-10)11-7-5-6-8-12(11)15-4/h5-8,10H,9H2,1-4H3 |
| InChI Key | ALOLSCLBNZSAMC-UHFFFAOYSA-N |
| MDL Number | MFCD22196586 |
| Molecular Formula | C13H19BO3 |
| Molecular Weight | 234.0992 |
| SMILES | O1(C(CC(C)OB1C2(=C(OC)C=CC=C2))(C)C) |
| Synonyms | 2-(2-methoxyphenyl)-4,4,6-trimethyl-1,3,2-dioxaborinane,
934558-37-9,
KS-000022LT,
MFCD28101501,
AKOS027384697,
AS-3017,
OR310861,
|
| Complexity | 257 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.143g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.102g/mol |
| Monoisotopic Mass | 234.143g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 27.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number