1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)-
TL;DR: 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)- (CAS 34848-39-0) is a chemical compound with molecular formula C9H8Cl2F4O3 and molecular weight 309.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-1-(furan-2-yl)butane-1,3-diol
Also Known As: 4-Chloro-4,4-difluoro-3-(chlorodifluoromethyl)-1-(2-furyl)-1,3-butanediol, 1,3-BUTANEDIOL, 4-CHLORO-3-CHLORODIFLUOROMETHYL-4,4-DIFLUORO-1-(2-FURYL)-, 4-chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-1-(furan-2-yl)butane-1,3-diol, 4-Chloro-3-(chlorodifluoromethyl)-4,4-difluoro-1-(2-furyl)-1,3-butanediol, 4-chloro-3-(chlorodifluoromethyl)-4,4-difluoro-1-(furan-2-yl)butane-1,3-diol
| Molecular Formula | C9H8Cl2F4O3 |
|---|---|
| Molecular Weight | 309.98 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.97867 |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 34848-39-0 |
|---|---|
| SMILES | C1=COC(=C1)C(CC(C(F)(F)Cl)(C(F)(F)Cl)O)O |
| InChIKey | AAWKFIIQLOMJEV-UHFFFAOYSA-N |
Product Overview
1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)- (CAS 34848-39-0), with molecular formula C9H8Cl2F4O3 and molecular weight 309.98 g/mol. IUPAC: 4-chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-1-(furan-2-yl)butane-1,3-diol.
Chemical Property Profile of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)-
Property Insights of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)-. With a topological polar surface area (TPSA) of 53.6 Ų, 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)- has 2 hydrogen bond donor(s) and 7 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 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)-?
The CAS number of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)- is 34848-39-0.
What is the molecular formula of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)-?
The molecular formula of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)- is C9H8Cl2F4O3.
What is the molecular weight of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)-?
The molecular weight of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)- is 309.98 g/mol.
Where can I buy 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)-?
You can request a quote for 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-furyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.