Spiro(4.5)decane
TL;DR: Spiro(4.5)decane (CAS 176-63-6) is a chemical compound with molecular formula C1CCC2(CC1)CCCC2 and molecular weight 138.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
spiro[4.5]decane
Also Known As: Spiro[4.5]decane, Spirodecane, Spiro[4.5]decan, Spiro(4-5)decane, Spiro(4.5)decane
| Molecular Formula | C1CCC2(CC1)CCCC2 |
|---|---|
| Molecular Weight | 138.14 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 138.14085 |
| Heavy Atoms | 10 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 176-63-6 |
|---|---|
| SMILES | C1CCC2(CC1)CCCC2 |
| InChIKey | CTDQAGUNKPRERK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Spiro(4.5)decane (CAS 176-63-6), with molecular formula C1CCC2(CC1)CCCC2 and molecular weight 138.14 g/mol. IUPAC: spiro[4.5]decane.
Chemical Property Profile of Spiro(4.5)decane
Property Insights of Spiro(4.5)decane
The XLogP value of 4.8 indicates that Spiro(4.5)decane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Spiro(4.5)decane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spiro(4.5)decane has 0 hydrogen bond donor(s) and 0 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 Spiro(4.5)decane?
The CAS number of Spiro(4.5)decane is 176-63-6.
What is the molecular formula of Spiro(4.5)decane?
The molecular formula of Spiro(4.5)decane is C1CCC2(CC1)CCCC2.
What is the molecular weight of Spiro(4.5)decane?
The molecular weight of Spiro(4.5)decane is 138.14 g/mol.
Where can I buy Spiro(4.5)decane?
You can request a quote for Spiro(4.5)decane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spiro(4.5)decane?
Yes, KEHONG BIO provides custom synthesis services for Spiro(4.5)decane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.