Apopinene
TL;DR: Apopinene (CAS 23978-82-7) is a chemical compound with molecular formula C9H14 and molecular weight 122.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,6-dimethylbicyclo[3.1.1]hept-2-ene
Also Known As: Apopinene, Apopinen, 6,6-Dimethylbicyclo[3.1.1]hept-2-ene, 6,6-Dimethylnorpin-2-ene, 2-Norpinene,6-dimethyl-
| Molecular Formula | C9H14 |
|---|---|
| Molecular Weight | 122.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 122.10955 |
| Heavy Atoms | 9 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 23978-82-7 |
|---|---|
| SMILES | CC1(C2CC=CC1C2)C |
| InChIKey | SUEFRHDDZDWKFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Apopinene (CAS 23978-82-7), with molecular formula C9H14 and molecular weight 122.11 g/mol. IUPAC: 6,6-dimethylbicyclo[3.1.1]hept-2-ene.
Chemical Property Profile of Apopinene
Property Insights of Apopinene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Apopinene. With a topological polar surface area (TPSA) of 0.0 Ų, Apopinene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Apopinene 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 Apopinene?
The CAS number of Apopinene is 23978-82-7.
What is the molecular formula of Apopinene?
The molecular formula of Apopinene is C9H14.
What is the molecular weight of Apopinene?
The molecular weight of Apopinene is 122.11 g/mol.
Where can I buy Apopinene?
You can request a quote for Apopinene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Apopinene?
Yes, KEHONG BIO provides custom synthesis services for Apopinene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.