Nonachloropentacyclononan-4-carbonsaeure
TL;DR: Nonachloropentacyclononan-4-carbonsaeure (CAS 1659-88-7) is a chemical compound with molecular formula C10HCl9O2 and molecular weight 467.72 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,5,6,7,8,9,9-nonachloropentacyclo[4.3.0.02,5.03,8.04,7]nonane-4-carboxylic acid
Also Known As: Nonachloropentacyclononan-4-carbonsaeure, 1,2,3,5,6,7,8,9,9-Nonachloropentacyclo[4.3.0.02,5.03,8.04,7]nonane-4-carboxylic acid, 1,2,3,5,6,7,8,9,9-Nonachloropentacyclo[4.3.0.0~2,5~.0~3,8~.0~4,7~]nonane-4-carboxylic acid
| Molecular Formula | C10HCl9O2 |
|---|---|
| Molecular Weight | 467.72 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 467.71732 |
| Heavy Atoms | 21 |
| Complexity | 689.0 |
Chemical Identifiers
| CAS Number | 1659-88-7 |
|---|---|
| SMILES | C(=O)(C12C3(C4(C1(C5(C2(C3(C4(C5(Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)O |
| InChIKey | KIPHSYRNRBDUBB-UHFFFAOYSA-N |
Product Overview
Nonachloropentacyclononan-4-carbonsaeure (CAS 1659-88-7), with molecular formula C10HCl9O2 and molecular weight 467.72 g/mol. IUPAC: 1,2,3,5,6,7,8,9,9-nonachloropentacyclo[4.3.0.02,5.03,8.04,7]nonane-4-carboxylic acid.
Chemical Property Profile of Nonachloropentacyclononan-4-carbonsaeure
Property Insights of Nonachloropentacyclononan-4-carbonsaeure
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nonachloropentacyclononan-4-carbonsaeure. With a topological polar surface area (TPSA) of 37.3 Ų, Nonachloropentacyclononan-4-carbonsaeure exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nonachloropentacyclononan-4-carbonsaeure has 1 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 Nonachloropentacyclononan-4-carbonsaeure?
The CAS number of Nonachloropentacyclononan-4-carbonsaeure is 1659-88-7.
What is the molecular formula of Nonachloropentacyclononan-4-carbonsaeure?
The molecular formula of Nonachloropentacyclononan-4-carbonsaeure is C10HCl9O2.
What is the molecular weight of Nonachloropentacyclononan-4-carbonsaeure?
The molecular weight of Nonachloropentacyclononan-4-carbonsaeure is 467.72 g/mol.
Where can I buy Nonachloropentacyclononan-4-carbonsaeure?
You can request a quote for Nonachloropentacyclononan-4-carbonsaeure directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nonachloropentacyclononan-4-carbonsaeure?
Yes, KEHONG BIO provides custom synthesis services for Nonachloropentacyclononan-4-carbonsaeure and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.