4-Bromo-4,4-difluorobutan-1-ol
TL;DR: 4-Bromo-4,4-difluorobutan-1-ol (CAS 155957-60-1) is a chemical compound with molecular formula C4H7BrF2O and molecular weight 187.96483 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromo-4,4-difluorobutan-1-ol
Also Known As: 4-bromo-4,4-difluorobutan-1-ol, pheniodolsodium, 4-bromo-4,4-difluoro-1-butanol, 4-bromo4,4-difluorobutanol, 4-bromo-4,4-difluorobutanol
Technical Specifications
| Molecular Formula | C4H7BrF2O |
| Molecular Weight | 187.96483 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 187.96483 Da |
| Heavy Atoms | 8 |
| Complexity | 67.0 |
| SMILES | C(CC(F)(F)Br)CO |
| InChIKey | YMVXWKFHZLGKAX-UHFFFAOYSA-N |
Chemical Property Profile of 4-Bromo-4,4-difluorobutan-1-ol
Property Insights of 4-Bromo-4,4-difluorobutan-1-ol
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-4,4-difluorobutan-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Bromo-4,4-difluorobutan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-4,4-difluorobutan-1-ol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Bromo-4,4-difluorobutan-1-ol?
The CAS number of 4-Bromo-4,4-difluorobutan-1-ol is 155957-60-1.
What is the molecular formula of 4-Bromo-4,4-difluorobutan-1-ol?
The molecular formula of 4-Bromo-4,4-difluorobutan-1-ol is C4H7BrF2O.
What is the molecular weight of 4-Bromo-4,4-difluorobutan-1-ol?
The molecular weight of 4-Bromo-4,4-difluorobutan-1-ol is 187.96483 g/mol.
Where can I buy 4-Bromo-4,4-difluorobutan-1-ol?
You can request a quote for 4-Bromo-4,4-difluorobutan-1-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Bromo-4,4-difluorobutan-1-ol?
Yes, CoreyChem provides custom synthesis services for 4-Bromo-4,4-difluorobutan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.