![11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile structure](/static/products/117/1177608-93-3.webp)
11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile
TL;DR: 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile (CAS 1177608-93-3) is a chemical compound with molecular formula C14H14N4O2 and molecular weight 270.11166 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
13-imino-11,12-dioxatricyclo[6.3.2.01,7]tridecane-8,9,9-tricarbonitrile
Also Known As: 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4(4H)-tricarbonitrile, 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile
Technical Specifications
| Molecular Formula | C14H14N4O2 |
| Molecular Weight | 270.11166 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 114.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 270.11166 Da |
| Heavy Atoms | 20 |
| Complexity | 613.0 |
| SMILES | C1CCC2C3(CC1)OCC(C2(C(=N)O3)C#N)(C#N)C#N |
| InChIKey | HOQAFHDNCGYPQY-UHFFFAOYSA-N |
Chemical Property Profile of 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile
Property Insights of 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile. Following Lipinski's Rule of Five, 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile?
The CAS number of 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile is 1177608-93-3.
What is the molecular formula of 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile?
The molecular formula of 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile is C14H14N4O2.
What is the molecular weight of 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile?
The molecular weight of 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile is 270.11166 g/mol.
Where can I buy 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile?
You can request a quote for 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile?
Yes, CoreyChem provides custom synthesis services for 11-iminohexahydro-2H-9a,4-(epoxymethano)cyclohepta[b]pyran-3,3,4-tricarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.