2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷
TL;DR: 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷 (CAS 74772-12-6) is a chemical compound with molecular formula C14H14 and molecular weight 182.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷
2,3,5,6,7,8-hexamethylidenebicyclo[2.2.2]octane
Also Known As: Bicyclo(2.2.2)octane, 2,3,5,6,7,8-hexa(methylene)-, 2,3,5,6,7,8-hexamethylidenebicyclo[2.2.2]octane, Bicyclo[2.2.2]octane,2,3,5,6,7,8-hexa(methylene)-, 2,3,5,6,7,8-hexamethylidenbicyclo [2.2.2]octane, RefChem:329270
| Molecular Formula | C14H14 |
|---|---|
| Molecular Weight | 182.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 182.10954 |
| Heavy Atoms | 14 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 74772-12-6 |
|---|---|
| SMILES | C=C1C2C(=C)C(=C)C(C1=C)C(=C)C2=C |
| InChIKey | PKBWUDMUEZIOQX-UHFFFAOYSA-N |
Product Overview
2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷 (CAS 74772-12-6), with molecular formula C14H14 and molecular weight 182.11 g/mol. IUPAC: 2,3,5,6,7,8-hexamethylidenebicyclo[2.2.2]octane.
Chemical Property Profile of 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷
Property Insights of 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷. With a topological polar surface area (TPSA) of 0.0 Ų, 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷 has 0 hydrogen bond donor(s) and 0 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 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷?
The CAS number of 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷 is 74772-12-6.
What is the molecular formula of 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷?
The molecular formula of 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷 is C14H14.
What is the molecular weight of 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷?
The molecular weight of 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷 is 182.11 g/mol.
Where can I buy 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷?
You can request a quote for 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷?
Yes, KEHONG BIO provides custom synthesis services for 2,3,5,6,7,8-六亚甲基双环［2.2.2］辛烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.