Chalcogran
TL;DR: Chalcogran (CAS 3871-99-6) is a chemical compound with molecular formula C9H16O2 and molecular weight 156.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-1,6-dioxaspiro[4.4]nonane
Also Known As: Chalcogran, 2-Ethyl-1,6-dioxaspiro[4.4]nonane, 2-Ethyl-1,6-dioxaspiro[4.4]-nonane, 2-Ethyl-1,6-dioxaspiro[4,4]nonane, 2-ethyl-1,6-dioxaspiro[4.4]nonan
| Molecular Formula | C9H16O2 |
|---|---|
| Molecular Weight | 156.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.11504 |
| Heavy Atoms | 11 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 3871-99-6 |
|---|---|
| SMILES | CCC1CCC2(O1)CCCO2 |
| InChIKey | DCWKALWZHORJAO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Chalcogran (CAS 3871-99-6), with molecular formula C9H16O2 and molecular weight 156.12 g/mol. IUPAC: 2-ethyl-1,6-dioxaspiro[4.4]nonane.
Chemical Property Profile of Chalcogran
Property Insights of Chalcogran
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chalcogran. With a topological polar surface area (TPSA) of 18.5 Ų, Chalcogran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chalcogran 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 Chalcogran?
The CAS number of Chalcogran is 3871-99-6.
What is the molecular formula of Chalcogran?
The molecular formula of Chalcogran is C9H16O2.
What is the molecular weight of Chalcogran?
The molecular weight of Chalcogran is 156.12 g/mol.
Where can I buy Chalcogran?
You can request a quote for Chalcogran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chalcogran?
Yes, KEHONG BIO provides custom synthesis services for Chalcogran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.