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Spiro[5.5]undec-1-en-3-one
TL;DR: Spiro[5.5]undec-1-en-3-one (CAS 30834-42-5) is a chemical compound with molecular formula C11H16O and molecular weight 164.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
spiro[5.5]undec-4-en-3-one
Also Known As: Spiro[5.5]undec-1-en-3-one, oxospiro[5.5]undecen, spiro[5.5]undec-4-en-3-one, -1,3,2-dioxaborolane, spiro[5.5]undecen-3-one
| Molecular Formula | C11H16O |
|---|---|
| Molecular Weight | 164.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.12012 |
| Heavy Atoms | 12 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 30834-42-5 |
|---|---|
| SMILES | C1CCC2(CC1)CCC(=O)C=C2 |
| InChIKey | VIESIESOPRMRGG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Spiro[5.5]undec-1-en-3-one (CAS 30834-42-5), with molecular formula C11H16O and molecular weight 164.12 g/mol. IUPAC: spiro[5.5]undec-4-en-3-one.
Chemical Property Profile of Spiro[5.5]undec-1-en-3-one
Property Insights of Spiro[5.5]undec-1-en-3-one
The XLogP value of 3.2 indicates that Spiro[5.5]undec-1-en-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[5.5]undec-1-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spiro[5.5]undec-1-en-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[5.5]undec-1-en-3-one?
The CAS number of Spiro[5.5]undec-1-en-3-one is 30834-42-5.
What is the molecular formula of Spiro[5.5]undec-1-en-3-one?
The molecular formula of Spiro[5.5]undec-1-en-3-one is C11H16O.
What is the molecular weight of Spiro[5.5]undec-1-en-3-one?
The molecular weight of Spiro[5.5]undec-1-en-3-one is 164.12 g/mol.
Where can I buy Spiro[5.5]undec-1-en-3-one?
You can request a quote for Spiro[5.5]undec-1-en-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[5.5]undec-1-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for Spiro[5.5]undec-1-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.