![2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile structure](/static/products/140/140650-87-9.png)
2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile
TL;DR: 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile (CAS 140650-87-9) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxo-1-oxaspiro[4.5]decane-4-carbonitrile
Also Known As: ChemDiv1_024676, 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile, 3-oxo-4-oxaspiro[4.5]decane-1-carbonitrile, 1-Oxaspiro[4,5]decane 4-carbonitrile, 2-oxo-, 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile #
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 50.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 140650-87-9 |
|---|---|
| SMILES | C1CCC2(CC1)C(CC(=O)O2)C#N |
| InChIKey | NNZWSEMPKDCORE-UHFFFAOYSA-N |
Product Overview
2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile (CAS 140650-87-9), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: 2-oxo-1-oxaspiro[4.5]decane-4-carbonitrile.
Chemical Property Profile of 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile
Property Insights of 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile. With a topological polar surface area (TPSA) of 50.1 Ų, 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile has 0 hydrogen bond donor(s) and 3 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 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile?
The CAS number of 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile is 140650-87-9.
What is the molecular formula of 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile?
The molecular formula of 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile is C10H13NO2.
What is the molecular weight of 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile?
The molecular weight of 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile is 179.09 g/mol.
Where can I buy 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile?
You can request a quote for 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-1-oxaspiro[4.5]decane-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.