![3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile structure](/static/products/884/88442-12-0.png)
3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile
TL;DR: 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile (CAS 88442-12-0) is a chemical compound with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile
Also Known As: NCI60_007445, 3-phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile, 2-Phenyl-6,10-dioxaspiro[4.5]dec-3-ene-1,1-dicarbonitrile, 6,10-Dioxaspiro[4.5]dec-3-ene-1,1-dicarbonitrile, 2-phenyl-, 5,5-dicyano-4-phenylcyclopent-2-enone 1,3-propanediyl ketal
| Molecular Formula | C16H14N2O2 |
|---|---|
| Molecular Weight | 266.11 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 266.10553 |
| Heavy Atoms | 20 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 88442-12-0 |
|---|---|
| SMILES | C1COC2(C=CC(C2(C#N)C#N)C3=CC=CC=C3)OC1 |
| InChIKey | PICWVYBQSYUNDQ-UHFFFAOYSA-N |
Product Overview
3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile (CAS 88442-12-0), with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol. IUPAC: 3-phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile.
Chemical Property Profile of 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile
Property Insights of 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile. Following Lipinski's Rule of Five, 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile has 0 hydrogen bond donor(s) and 4 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 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile?
The CAS number of 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile is 88442-12-0.
What is the molecular formula of 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile?
The molecular formula of 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile is C16H14N2O2.
What is the molecular weight of 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile?
The molecular weight of 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile is 266.11 g/mol.
Where can I buy 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile?
You can request a quote for 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.