TL;DR: Benzenediazonium, 3-chloro-4-(dimethylamino)- (CAS 51065-17-9) is a chemical compound with molecular formula C8H9ClN3+ and molecular weight 182.0485 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-chloro-4-(dimethylamino)benzenediazonium
Also Known As: 3-chloro-4-dimethylamino-benzenediazonium, 3-chloro-4-(dimethylamino)benzenediazonium, Benzenediazonium, 3-chloro-4-(dimethylamino)-, 3-chloro-4-(dimethylamino)benzene-1-diazonium, (2R,3r)-1,4-di-o-tosyl-2,3-o-isopropylidene-d-threitol
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H9ClN3+ |
| Molecular Weight | 182.0485 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 31.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.0485 Da |
| Heavy Atoms | 12 |
| Complexity | 196.0 |
| SMILES | CN(C)C1=C(C=C(C=C1)[N+]#N)Cl |
| InChIKey | GVVSBXXPMFLAIY-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that Benzenediazonium, 3-chloro-4-(dimethylamino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.4 Ų, Benzenediazonium, 3-chloro-4-(dimethylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenediazonium, 3-chloro-4-(dimethylamino)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzenediazonium, 3-chloro-4-(dimethylamino)- is 51065-17-9.
The molecular formula of Benzenediazonium, 3-chloro-4-(dimethylamino)- is C8H9ClN3+.
The molecular weight of Benzenediazonium, 3-chloro-4-(dimethylamino)- is 182.0485 g/mol.
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