己二醯氯
TL;DR: 己二醯氯 (CAS 111-50-2) is a chemical compound with molecular formula C6H8Cl2O2 and molecular weight 181.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
己二醯氯
hexanedioyl dichloride
Also Known As: Adipoyl chloride, Adipoyl dichloride, HEXANEDIOYL DICHLORIDE, Adipyl chloride, adipoylchloride
| Molecular Formula | C6H8Cl2O2 |
|---|---|
| Molecular Weight | 181.99 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 181.99013 |
| Heavy Atoms | 10 |
| Complexity | 118.0 |
Chemical Identifiers
| CAS Number | 111-50-2 |
|---|---|
| SMILES | C(CCC(=O)Cl)CC(=O)Cl |
| InChIKey | PWAXUOGZOSVGBO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
己二醯氯 (CAS 111-50-2), with molecular formula C6H8Cl2O2 and molecular weight 181.99 g/mol. IUPAC: hexanedioyl dichloride.
Chemical Property Profile of 己二醯氯
Property Insights of 己二醯氯
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 己二醯氯. With a topological polar surface area (TPSA) of 34.1 Ų, 己二醯氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 己二醯氯 has 0 hydrogen bond donor(s) and 2 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 己二醯氯?
The CAS number of 己二醯氯 is 111-50-2.
What is the molecular formula of 己二醯氯?
The molecular formula of 己二醯氯 is C6H8Cl2O2.
What is the molecular weight of 己二醯氯?
The molecular weight of 己二醯氯 is 181.99 g/mol.
Where can I buy 己二醯氯?
You can request a quote for 己二醯氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 己二醯氯?
Yes, KEHONG BIO provides custom synthesis services for 己二醯氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.