1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)-
TL;DR: 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)- (CAS 34848-40-3) is a chemical compound with molecular formula C9H8Cl2F4O2S and molecular weight 325.96 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-thiophen-2-ylbutane-1,3-diol
Also Known As: 4-Chloro-3-(chlorodifluoromethyl)-4,4-difluoro-1-(2-thienyl)-1,3-butanediol, 1,3-BUTANEDIOL, 4-CHLORO-3-CHLORODIFLUOROMETHYL-4,4-DIFLUORO-1-(2-THIENYL)-, 4-chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-1-thiophen-, 4-CHLORO-3-(CHLORODIFLUOROMETHYL)-4,4-DIFLUORO-1-(THIOPHEN-2-YL)BUTANE-1,3-DIOL, 4-chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-1-thiophen-2-ylbutane-1,3-diol
| Molecular Formula | C9H8Cl2F4O2S |
|---|---|
| Molecular Weight | 325.96 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 68.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.9558 |
| Heavy Atoms | 18 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 34848-40-3 |
|---|---|
| SMILES | C1=CSC(=C1)C(CC(C(F)(F)Cl)(C(F)(F)Cl)O)O |
| InChIKey | FHFTVNAEXGVSCO-UHFFFAOYSA-N |
Product Overview
1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)- (CAS 34848-40-3), with molecular formula C9H8Cl2F4O2S and molecular weight 325.96 g/mol. IUPAC: 4-chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-1-thiophen-2-ylbutane-1,3-diol.
Chemical Property Profile of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)-
Property Insights of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)-
The XLogP value of 3.1 indicates that 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)-. Following Lipinski's Rule of Five, 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)- 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-thienyl)-?
The CAS number of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)- is 34848-40-3.
What is the molecular formula of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)-?
The molecular formula of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)- is C9H8Cl2F4O2S.
What is the molecular weight of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)-?
The molecular weight of 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)- is 325.96 g/mol.
Where can I buy 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)-?
You can request a quote for 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)- 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-thienyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Butanediol, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-1-(2-thienyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.