| CAS Number | 1414923-65-1 |
| Catalog Number | AG019RZS |
| Chemical Name | 4,4,5,5-Tetramethyl-2-{3-[(methylsulfanyl)methyl]phenyl}-1,3,2-dioxaborolane |
| IUPAC Name | 4,4,5,5-tetramethyl-2-[3-(methylsulfanylmethyl)phenyl]-1,3,2-dioxaborolane |
| InChI | InChI=1S/C14H21BO2S/c1-13(2)14(3,4)17-15(16-13)12-8-6-7-11(9-12)10-18-5/h6-9H,10H2,1-5H3 |
| InChI Key | INHVOEQSPJORCU-UHFFFAOYSA-N |
| MDL Number | MFCD20441718 |
| Molecular Formula | C14H21BO2S |
| Molecular Weight | 264.1913 |
| SMILES | CC1(OB(OC1(C)C)C1=CC(=CC=C1)CSC)C |
| Synonyms | 4,4,5,5-tetramethyl-2-{3-[(methylsulfanyl)methyl]phenyl}-1,3,2-dioxaborolane,
1414923-65-1,
AKOS017528277,
ZINC169961276,
NE40882,
EN300-91248,
|
| Complexity | 278 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 264.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 264.19g/mol |
| Monoisotopic Mass | 264.136g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number