TL;DR: 2,3-Dichloropropionaldehyde (CAS 10140-89-3) is a chemical compound with molecular formula C3H4Cl2O and molecular weight 125.96392 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3-dichloropropanal
Also Known As: 2,3-Dichloropropanal, 2,3-Dichloropropionaldehyde, Propanal, 2,3-dichloro-, 1,2-Dichloro-3-propional, Dichloropropylaldehyde
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C3H4Cl2O |
| Molecular Weight | 125.96392 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 125.96392 Da |
| Heavy Atoms | 6 |
| Complexity | 46.0 |
| SMILES | C(C(C=O)Cl)Cl |
| InChIKey | IZRKUJREXIKAQM-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dichloropropionaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, 2,3-Dichloropropionaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dichloropropionaldehyde has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,3-Dichloropropionaldehyde is 10140-89-3.
The molecular formula of 2,3-Dichloropropionaldehyde is C3H4Cl2O.
The molecular weight of 2,3-Dichloropropionaldehyde is 125.96392 g/mol.
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