Spiro(5.7)tridec-1-ene-3-one
TL;DR: Spiro(5.7)tridec-1-ene-3-one (CAS 60033-39-8) is a chemical compound with molecular formula C13H20O and molecular weight 192.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
spiro[5.7]tridec-4-en-3-one
Also Known As: spiro[5.7]tridec-4-en-3-one, Spiro(5.7)tridec-1-ene-3-one, spiro[5.7]tridec-1-en-3-one, Spiro[5.7]tridec-1-ene-3-one, Spiro[5,7]trideca-1,4-dien-3-one
| Molecular Formula | C13H20O |
|---|---|
| Molecular Weight | 192.15 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 192.15141 |
| Heavy Atoms | 14 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 60033-39-8 |
|---|---|
| SMILES | C1CCCC2(CCC1)CCC(=O)C=C2 |
| InChIKey | NPVAAOCDILSFAY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Spiro(5.7)tridec-1-ene-3-one (CAS 60033-39-8), with molecular formula C13H20O and molecular weight 192.15 g/mol. IUPAC: spiro[5.7]tridec-4-en-3-one.
Chemical Property Profile of Spiro(5.7)tridec-1-ene-3-one
Property Insights of Spiro(5.7)tridec-1-ene-3-one
The XLogP value of 4.3 indicates that Spiro(5.7)tridec-1-ene-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Spiro(5.7)tridec-1-ene-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spiro(5.7)tridec-1-ene-3-one has 0 hydrogen bond donor(s) and 1 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(5.7)tridec-1-ene-3-one?
The CAS number of Spiro(5.7)tridec-1-ene-3-one is 60033-39-8.
What is the molecular formula of Spiro(5.7)tridec-1-ene-3-one?
The molecular formula of Spiro(5.7)tridec-1-ene-3-one is C13H20O.
What is the molecular weight of Spiro(5.7)tridec-1-ene-3-one?
The molecular weight of Spiro(5.7)tridec-1-ene-3-one is 192.15 g/mol.
Where can I buy Spiro(5.7)tridec-1-ene-3-one?
You can request a quote for Spiro(5.7)tridec-1-ene-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spiro(5.7)tridec-1-ene-3-one?
Yes, KEHONG BIO provides custom synthesis services for Spiro(5.7)tridec-1-ene-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.