3,3-Dimethylcyclopentene
TL;DR: 3,3-Dimethylcyclopentene (CAS 58049-91-5) is a chemical compound with molecular formula C7H12 and molecular weight 96.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethylcyclopentene
Also Known As: 3,3-Dimethylcyclopentene, 3,3-Dimethyl-1-cyclopentene, Cyclopentene, 3,3-dimethyl-, Cyclopentene,3,3-dimethyl-, 3,3-dimethyl-cyclopentene
| Molecular Formula | C7H12 |
|---|---|
| Molecular Weight | 96.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 96.0939 |
| Heavy Atoms | 7 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 58049-91-5 |
|---|---|
| SMILES | CC1(CCC=C1)C |
| InChIKey | FONFXXNTLGAHGI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3-Dimethylcyclopentene (CAS 58049-91-5), with molecular formula C7H12 and molecular weight 96.09 g/mol. IUPAC: 3,3-dimethylcyclopentene.
Chemical Property Profile of 3,3-Dimethylcyclopentene
Property Insights of 3,3-Dimethylcyclopentene
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Dimethylcyclopentene. With a topological polar surface area (TPSA) of 0.0 Ų, 3,3-Dimethylcyclopentene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethylcyclopentene 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 3,3-Dimethylcyclopentene?
The CAS number of 3,3-Dimethylcyclopentene is 58049-91-5.
What is the molecular formula of 3,3-Dimethylcyclopentene?
The molecular formula of 3,3-Dimethylcyclopentene is C7H12.
What is the molecular weight of 3,3-Dimethylcyclopentene?
The molecular weight of 3,3-Dimethylcyclopentene is 96.09 g/mol.
Where can I buy 3,3-Dimethylcyclopentene?
You can request a quote for 3,3-Dimethylcyclopentene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethylcyclopentene?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethylcyclopentene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.