2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene
TL;DR: 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene (CAS 646477-46-5) is a chemical compound with molecular formula C11H6Br2N2 and molecular weight 323.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,8-dibromotricyclo[3.3.1.01,5]nona-2,6-diene-2,6-dicarbonitrile
Also Known As: 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene, 1H,4H-3a,6a-Methanopentalene-3,6-dicarbonitrile, 1,4-dibromo-, 1,4-Dibromo-1H,4H-3a,6a-methanopentalene-3,6-dicarbonitrile, 4,8-dibromotricyclo[3.3.1.0^{1,5}]nona-2,6-diene-2,6-dicarbonitrile
| Molecular Formula | C11H6Br2N2 |
|---|---|
| Molecular Weight | 323.89 g/mol |
| LogP | 2.81706 |
| Topological Polar Surface Area | 47.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 323.88977 |
| Heavy Atoms | 15 |
| Complexity | 461.6614 |
Chemical Identifiers
| CAS Number | 646477-46-5 |
|---|---|
| SMILES | C1C23C1(C(C=C2C#N)Br)C(=CC3Br)C#N |
Product Overview
2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene (CAS 646477-46-5), with molecular formula C11H6Br2N2 and molecular weight 323.89 g/mol. IUPAC: 4,8-dibromotricyclo[3.3.1.01,5]nona-2,6-diene-2,6-dicarbonitrile.
Chemical Property Profile of 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene
Property Insights of 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene
The XLogP value of 2.81706 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene. With a topological polar surface area (TPSA) of 47.58 Ų, 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene has 0 hydrogen bond donor(s) and 2 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 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene?
The CAS number of 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene is 646477-46-5.
What is the molecular formula of 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene?
The molecular formula of 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene is C11H6Br2N2.
What is the molecular weight of 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene?
The molecular weight of 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene is 323.89 g/mol.
Where can I buy 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene?
You can request a quote for 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dibromo-4,8-dicyanotricyclo[3.3.1.0(1,5)]nona-3,7-diene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.