TL;DR: 2-Chlorodopamine (CAS 102851-70-7) is a chemical compound with molecular formula C8H10ClNO2 and molecular weight 187.04001 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-aminoethyl)-3-chlorobenzene-1,2-diol
Also Known As: 2-Chlorodopamine, Dopamine Impurity 5, Dopamine Impurity 67, 4-(2-aminoethyl)-3-chlorobenzene-1,2-diol, 1,2-Benzenediol,4-(2-aminoethyl)-3-chloro-
| Molecular Formula | C8H10ClNO2 |
| Molecular Weight | 187.04001 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.04001 Da |
| Heavy Atoms | 12 |
| Complexity | 145.0 |
| SMILES | C1=CC(=C(C(=C1CCN)Cl)O)O |
| InChIKey | QJFLNNIHWWVCFG-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chlorodopamine. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chlorodopamine. Following Lipinski's Rule of Five, 2-Chlorodopamine has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Chlorodopamine is 102851-70-7.
The molecular formula of 2-Chlorodopamine is C8H10ClNO2.
The molecular weight of 2-Chlorodopamine is 187.04001 g/mol.
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