| CAS Number | 848029-29-8 |
| Catalog Number | AG01C49Z(AGN-PC-00G6CD) |
| Chemical Name | (cyclopentylmethyl)boronic acid |
| IUPAC Name | cyclopentylmethylboronic acid |
| InChI | InChI=1S/C6H13BO2/c8-7(9)5-6-3-1-2-4-6/h6,8-9H,1-5H2 |
| InChI Key | ZCPPSCQFDMXZJK-UHFFFAOYSA-N |
| MDL Number | MFCD18861702 |
| Molecular Formula | C6H13BO2 |
| Molecular Weight | 127.9772 |
| SMILES | C1(CCCC1)CB(O)O |
| Synonyms | (Cyclopentylmethyl)boronic acid,
848029-29-8,
DTXSID10472597,
Boronic acid, B-(cyclopentylmethyl)-,
AKOS013015555,
ZINC196264846,
AK00782974,
D-1516,
Cyclopentylmethylboronic Acid,
CID11788309,
|
| Complexity | 79.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 128.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 127.978g/mol |
| Monoisotopic Mass | 128.101g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number