| CAS Number | 2098215-65-5 |
| Catalog Number | AG00IM98(AGN-PC-0WG39Y) |
| Chemical Name | 2-Cyclopropylpyridine-3-boronicAcidPinacolEster |
| IUPAC Name | 2-cyclopropyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
| InChI | InChI=1S/C14H20BNO2/c1-13(2)14(3,4)18-15(17-13)11-6-5-9-16-12(11)10-7-8-10/h5-6,9-10H,7-8H2,1-4H3 |
| InChI Key | BTUATTSYEKDRSV-UHFFFAOYSA-N |
| MDL Number | MFCD18733626 |
| Molecular Formula | C14H20BNO2 |
| Molecular Weight | 245.1251 |
| SMILES | CC1(C)C(C)(C)OB(C2=CC=CN=C2C3CC3)O1 |
| Synonyms | 2-Cyclopropylpyridine-3-boronic Acid Pinacol Ester,
2098215-65-5,
MFCD18733626,
AKOS032455767,
ZINC224681888,
CS-11741,
SY029187,
MFCD18733626 (95%),
|
| Complexity | 312 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.159g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.129g/mol |
| Monoisotopic Mass | 245.159g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 31.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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