Chloroacetaldehyde
TL;DR: Chloroacetaldehyde (CAS 107-20-0) is a chemical compound with molecular formula C2H3ClO and molecular weight 77.98724 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloroacetaldehyde
Also Known As: CHLOROACETALDEHYDE, 2-chloroacetaldehyde, Chloroethanal, 2-Chloroethanal, Chloroaldehyde
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C2H3ClO |
| Molecular Weight | 77.98724 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 77.98724 Da |
| Heavy Atoms | 4 |
| Complexity | 20.0 |
| Melting Point | 3 °F (USCG, 1999) |
| Boiling Point | 185 °F at 760 mmHg (NTP, 1992) |
| Density | 1.19 at 77 °F (USCG, 1999) - Denser than water; will sink |
| Flash Point | 190 °F (NTP, 1992) |
| Vapor Pressure | 100 mmHg at 113 °F (40% aqueous solution) (NTP, 1992) |
| Refractive Index | Index of refraction: 1.397 at 25 °C |
| Solubility | greater than or equal to 100 mg/mL at 66 °F (NTP, 1992) |
| SMILES | C(C=O)Cl |
| InChIKey | QSKPIOLLBIHNAC-UHFFFAOYSA-N |
Chemical Property Profile of Chloroacetaldehyde
Property Insights of Chloroacetaldehyde
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chloroacetaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, Chloroacetaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chloroacetaldehyde has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Chloroacetaldehyde?
The CAS number of Chloroacetaldehyde is 107-20-0.
What is the molecular formula of Chloroacetaldehyde?
The molecular formula of Chloroacetaldehyde is C2H3ClO.
What is the molecular weight of Chloroacetaldehyde?
The molecular weight of Chloroacetaldehyde is 77.98724 g/mol.
Where can I buy Chloroacetaldehyde?
You can request a quote for Chloroacetaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Chloroacetaldehyde?
Yes, CoreyChem provides custom synthesis services for Chloroacetaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.