2,2,3-三氯丙醛
TL;DR: 2,2,3-三氯丙醛 (CAS 7789-90-4) is a chemical compound with molecular formula C3H3Cl3O and molecular weight 159.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3-三氯丙醛
2,2,3-trichloropropanal
Also Known As: 2,2,3-Trichloropropanal, Propanal, 2,2,3-trichloro-, 2,2,3-TRICHLOROPROPIONALDEHYDE, Propionaldehyde, 2,2,3-trichloro-, 2,2,3-trichloro-propionaldehyde
| Molecular Formula | C3H3Cl3O |
|---|---|
| Molecular Weight | 159.92 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 159.92494 |
| Heavy Atoms | 7 |
| Complexity | 70.0 |
Chemical Identifiers
| CAS Number | 7789-90-4 |
|---|---|
| SMILES | C(C(C=O)(Cl)Cl)Cl |
| InChIKey | VMVQOWJGWBIGEU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2,3-三氯丙醛 (CAS 7789-90-4), with molecular formula C3H3Cl3O and molecular weight 159.92 g/mol. IUPAC: 2,2,3-trichloropropanal.
Chemical Property Profile of 2,2,3-三氯丙醛
Property Insights of 2,2,3-三氯丙醛
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,3-三氯丙醛. With a topological polar surface area (TPSA) of 17.1 Ų, 2,2,3-三氯丙醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,3-三氯丙醛 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 2,2,3-三氯丙醛?
The CAS number of 2,2,3-三氯丙醛 is 7789-90-4.
What is the molecular formula of 2,2,3-三氯丙醛?
The molecular formula of 2,2,3-三氯丙醛 is C3H3Cl3O.
What is the molecular weight of 2,2,3-三氯丙醛?
The molecular weight of 2,2,3-三氯丙醛 is 159.92 g/mol.
Where can I buy 2,2,3-三氯丙醛?
You can request a quote for 2,2,3-三氯丙醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,3-三氯丙醛?
Yes, KEHONG BIO provides custom synthesis services for 2,2,3-三氯丙醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.