2-Chloro-2,2-difluoroacetaldehyde
TL;DR: 2-Chloro-2,2-difluoroacetaldehyde (CAS 811-96-1) is a chemical compound with molecular formula C2HClF2O and molecular weight 113.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-2,2-difluoroacetaldehyde
Also Known As: Chlorodifluoroacetaldehyde, Acetaldehyde, chlorodifluoro-, 2-chloro-2,2-difluoroacetaldehyde, C2HClF2O, Chloro(difluoro)acetaldehyde
| Molecular Formula | C2HClF2O |
|---|---|
| Molecular Weight | 113.97 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 113.9684 |
| Heavy Atoms | 6 |
| Complexity | 62.0 |
Chemical Identifiers
| CAS Number | 811-96-1 |
|---|---|
| SMILES | C(=O)C(F)(F)Cl |
| InChIKey | PRGCVNDIGVIGBQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-2,2-difluoroacetaldehyde (CAS 811-96-1), with molecular formula C2HClF2O and molecular weight 113.97 g/mol. IUPAC: 2-chloro-2,2-difluoroacetaldehyde.
Chemical Property Profile of 2-Chloro-2,2-difluoroacetaldehyde
Property Insights of 2-Chloro-2,2-difluoroacetaldehyde
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-2,2-difluoroacetaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Chloro-2,2-difluoroacetaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-2,2-difluoroacetaldehyde has 0 hydrogen bond donor(s) and 3 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-Chloro-2,2-difluoroacetaldehyde?
The CAS number of 2-Chloro-2,2-difluoroacetaldehyde is 811-96-1.
What is the molecular formula of 2-Chloro-2,2-difluoroacetaldehyde?
The molecular formula of 2-Chloro-2,2-difluoroacetaldehyde is C2HClF2O.
What is the molecular weight of 2-Chloro-2,2-difluoroacetaldehyde?
The molecular weight of 2-Chloro-2,2-difluoroacetaldehyde is 113.97 g/mol.
Where can I buy 2-Chloro-2,2-difluoroacetaldehyde?
You can request a quote for 2-Chloro-2,2-difluoroacetaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-2,2-difluoroacetaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-2,2-difluoroacetaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.