| CAS Number | 1539314-85-6 |
| Catalog Number | AG003AG9(AGN-PC-0WGGAF) |
| Chemical Name | 9,9-Dimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9h-fluorene-2-carbonitrile |
| IUPAC Name | 9,9-dimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluorene-2-carbonitrile |
| InChI | InChI=1S/C22H24BNO2/c1-20(2)18-11-14(13-24)7-9-16(18)17-10-8-15(12-19(17)20)23-25-21(3,4)22(5,6)26-23/h7-12H,1-6H3 |
| InChI Key | FBEWREHWMQOAHH-UHFFFAOYSA-N |
| MDL Number | MFCD31916408 |
| Molecular Formula | C22H24BNO2 |
| Molecular Weight | 345.2425 |
| SMILES | CC1(C2=CC(=CC=C2C=2C=CC(=CC12)C#N)B1OC(C(O1)(C)C)(C)C)C |
| Synonyms | 9,9-Dimethyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9H-fluorene-2-carbonitrile,
1539314-85-6,
SCHEMBL15763536,
AS-55256,
|
| Complexity | 603 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 345.19g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 345.249g/mol |
| Monoisotopic Mass | 345.19g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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