1-(Bromodifluoromethyl)cyclohex-1-ene
TL;DR: 1-(Bromodifluoromethyl)cyclohex-1-ene (CAS 117711-60-1) is a chemical compound with molecular formula C7H9BrF2 and molecular weight 209.98557 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[bromo(difluoro)methyl]cyclohexene
Also Known As: 1-(Bromodifluoromethyl)cyclohex-1-ene, 1-(Bromodifluoromethyl)cyclohexene, 1-[bromo(difluoro)methyl]cyclohexene, Cyclohexene, 1-(bromodifluoromethyl)-, Cyclohexene,1-(bromodifluoromethyl)-
Technical Specifications
| Molecular Formula | C7H9BrF2 |
| Molecular Weight | 209.98557 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.98557 Da |
| Heavy Atoms | 10 |
| Complexity | 152.0 |
| SMILES | C1CCC(=CC1)C(F)(F)Br |
| InChIKey | PJIZWHYAFYTIMP-UHFFFAOYSA-N |
Chemical Property Profile of 1-(Bromodifluoromethyl)cyclohex-1-ene
Property Insights of 1-(Bromodifluoromethyl)cyclohex-1-ene
The XLogP value of 3.3 indicates that 1-(Bromodifluoromethyl)cyclohex-1-ene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-(Bromodifluoromethyl)cyclohex-1-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Bromodifluoromethyl)cyclohex-1-ene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(Bromodifluoromethyl)cyclohex-1-ene?
The CAS number of 1-(Bromodifluoromethyl)cyclohex-1-ene is 117711-60-1.
What is the molecular formula of 1-(Bromodifluoromethyl)cyclohex-1-ene?
The molecular formula of 1-(Bromodifluoromethyl)cyclohex-1-ene is C7H9BrF2.
What is the molecular weight of 1-(Bromodifluoromethyl)cyclohex-1-ene?
The molecular weight of 1-(Bromodifluoromethyl)cyclohex-1-ene is 209.98557 g/mol.
Where can I buy 1-(Bromodifluoromethyl)cyclohex-1-ene?
You can request a quote for 1-(Bromodifluoromethyl)cyclohex-1-ene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(Bromodifluoromethyl)cyclohex-1-ene?
Yes, CoreyChem provides custom synthesis services for 1-(Bromodifluoromethyl)cyclohex-1-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.