3-Bromocyclohexene
TL;DR: 3-Bromocyclohexene (CAS 108055-90-9) is a chemical compound with molecular formula C1CC=CC(C1)Br and molecular weight 159.98875 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-bromocyclohexene
Also Known As: 3-Bromocyclohexene, 3-Bromocyclohex-1-ene, Cyclohexene, 3-bromo-, 3-bromo-cyclohexene, 1-Bromo-2-cyclohexene
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C1CC=CC(C1)Br |
| Molecular Weight | 159.98875 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.98875 Da |
| Heavy Atoms | 7 |
| Complexity | 76.0 |
| SMILES | C1CC=CC(C1)Br |
| InChIKey | AJKDUJRRWLQXHM-UHFFFAOYSA-N |
Chemical Property Profile of 3-Bromocyclohexene
Property Insights of 3-Bromocyclohexene
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromocyclohexene. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Bromocyclohexene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromocyclohexene 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
What is the CAS number of 3-Bromocyclohexene?
The CAS number of 3-Bromocyclohexene is 108055-90-9.
What is the molecular formula of 3-Bromocyclohexene?
The molecular formula of 3-Bromocyclohexene is C1CC=CC(C1)Br.
What is the molecular weight of 3-Bromocyclohexene?
The molecular weight of 3-Bromocyclohexene is 159.98875 g/mol.
Where can I buy 3-Bromocyclohexene?
You can request a quote for 3-Bromocyclohexene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Bromocyclohexene?
Yes, CoreyChem provides custom synthesis services for 3-Bromocyclohexene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.