| CAS Number | 1402238-28-1 |
| Catalog Number | AG009WU6(AGN-PC-0WA8H1) |
| Chemical Name | 3-Chloro-5-(pyrrolidin-1-yl)phenylboronic acid |
| IUPAC Name | (3-chloro-5-pyrrolidin-1-ylphenyl)boronic acid |
| InChI | InChI=1S/C10H13BClNO2/c12-9-5-8(11(14)15)6-10(7-9)13-3-1-2-4-13/h5-7,14-15H,1-4H2 |
| InChI Key | DUNHVJDDMIGSQO-UHFFFAOYSA-N |
| MDL Number | MFCD18783126 |
| Molecular Formula | C10H13BClNO2 |
| Molecular Weight | 225.4797 |
| SMILES | Clc1cc(cc(c1)N1CCCC1)B(O)O |
| Synonyms | 1402238-28-1,
3-CHLORO-5-(PYRROLIDIN-1-YL)PHENYLBORONIC ACID,
(3-Chloro-5-(pyrrolidin-1-yl)phenyl)boronic acid,
MFCD18783126,
AKOS022185164,
ZINC169934849,
OR360995,
SC-54048,
V3039,
A-3394,
C10H13BClNO2,
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| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.479g/mol |
| Monoisotopic Mass | 225.073g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number