1,2-Didehydroadamantane
TL;DR: 1,2-Didehydroadamantane (CAS 3925-73-3) is a chemical compound with molecular formula C10H14 and molecular weight 134.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tricyclo[3.3.1.13,7]dec-1-ene
Also Known As: Dehydroadamantane, adamantene, 1,2-Didehydroadamantane, tricyclo[3.3.1.13,7]dec-1-ene, Bis-(2.3-dibromo-propyl)-fumarate
| Molecular Formula | C10H14 |
|---|---|
| Molecular Weight | 134.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 134.10954 |
| Heavy Atoms | 10 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 3925-73-3 |
|---|---|
| SMILES | C1C2CC3CC1CC(=C3)C2 |
| InChIKey | BZDWENUBDLILHM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Didehydroadamantane (CAS 3925-73-3), with molecular formula C10H14 and molecular weight 134.11 g/mol. IUPAC: tricyclo[3.3.1.13,7]dec-1-ene.
Chemical Property Profile of 1,2-Didehydroadamantane
Property Insights of 1,2-Didehydroadamantane
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Didehydroadamantane. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Didehydroadamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Didehydroadamantane 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 1,2-Didehydroadamantane?
The CAS number of 1,2-Didehydroadamantane is 3925-73-3.
What is the molecular formula of 1,2-Didehydroadamantane?
The molecular formula of 1,2-Didehydroadamantane is C10H14.
What is the molecular weight of 1,2-Didehydroadamantane?
The molecular weight of 1,2-Didehydroadamantane is 134.11 g/mol.
Where can I buy 1,2-Didehydroadamantane?
You can request a quote for 1,2-Didehydroadamantane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Didehydroadamantane?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Didehydroadamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.