2,6-Dichlorobenzaldehyde
TL;DR: 2,6-Dichlorobenzaldehyde (CAS 83-38-5) is a chemical compound with molecular formula C7H4Cl2O and molecular weight 173.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dichlorobenzaldehyde
Also Known As: 2,6-DICHLOROBENZALDEHYDE, Benzaldehyde, 2,6-dichloro-, null, 2,6-dichlorbenzaldehyd, 2,6-dichloro benzaldehyde
| Molecular Formula | C7H4Cl2O |
|---|---|
| Molecular Weight | 173.96 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.96391 |
| Heavy Atoms | 10 |
| Complexity | 117.0 |
| Melting Point | 158 to 71.1 °C |
| Boiling Point | 165.0 °C at 760 mmHg |
| Solubility | less than 1 mg/mL at 73 °F (NTP, 1992) |
| Flash Point | 135.0 °C |
Chemical Identifiers
| CAS Number | 83-38-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)C=O)Cl |
| InChIKey | DMIYKWPEFRFTPY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Dichlorobenzaldehyde (CAS 83-38-5), with molecular formula C7H4Cl2O and molecular weight 173.96 g/mol. IUPAC: 2,6-dichlorobenzaldehyde.
Chemical Property Profile of 2,6-Dichlorobenzaldehyde
Property Insights of 2,6-Dichlorobenzaldehyde
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dichlorobenzaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, 2,6-Dichlorobenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dichlorobenzaldehyde 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
Frequently Asked Questions
What is the CAS number of 2,6-Dichlorobenzaldehyde?
The CAS number of 2,6-Dichlorobenzaldehyde is 83-38-5.
What is the molecular formula of 2,6-Dichlorobenzaldehyde?
The molecular formula of 2,6-Dichlorobenzaldehyde is C7H4Cl2O.
What is the molecular weight of 2,6-Dichlorobenzaldehyde?
The molecular weight of 2,6-Dichlorobenzaldehyde is 173.96 g/mol.
Where can I buy 2,6-Dichlorobenzaldehyde?
You can request a quote for 2,6-Dichlorobenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dichlorobenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dichlorobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.