2-Butanol, 4,4-difluoro-
TL;DR: 2-Butanol, 4,4-difluoro- (CAS 64037-40-7) is a chemical compound with molecular formula C4H8F2O and molecular weight 110.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-difluorobutan-2-ol
Also Known As: 4,4-Difluoro-2-butanol, 4,4-difluorobutan-2-ol, 2-BUTANOL, 4,4-DIFLUORO-, RefChem:1062515
| Molecular Formula | C4H8F2O |
|---|---|
| Molecular Weight | 110.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 110.05432 |
| Heavy Atoms | 7 |
| Complexity | 47.0 |
Chemical Identifiers
| CAS Number | 64037-40-7 |
|---|---|
| SMILES | CC(CC(F)F)O |
| InChIKey | CTEKRDCXQUAXMK-UHFFFAOYSA-N |
Product Overview
2-Butanol, 4,4-difluoro- (CAS 64037-40-7), with molecular formula C4H8F2O and molecular weight 110.05 g/mol. IUPAC: 4,4-difluorobutan-2-ol.
Chemical Property Profile of 2-Butanol, 4,4-difluoro-
Property Insights of 2-Butanol, 4,4-difluoro-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butanol, 4,4-difluoro-. With a topological polar surface area (TPSA) of 20.2 Ų, 2-Butanol, 4,4-difluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butanol, 4,4-difluoro- 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
Frequently Asked Questions
What is the CAS number of 2-Butanol, 4,4-difluoro-?
The CAS number of 2-Butanol, 4,4-difluoro- is 64037-40-7.
What is the molecular formula of 2-Butanol, 4,4-difluoro-?
The molecular formula of 2-Butanol, 4,4-difluoro- is C4H8F2O.
What is the molecular weight of 2-Butanol, 4,4-difluoro-?
The molecular weight of 2-Butanol, 4,4-difluoro- is 110.05 g/mol.
Where can I buy 2-Butanol, 4,4-difluoro-?
You can request a quote for 2-Butanol, 4,4-difluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butanol, 4,4-difluoro-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butanol, 4,4-difluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.