Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)-
TL;DR: Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)- (CAS 100482-83-5) is a chemical compound with molecular formula C5H4ClF5O2 and molecular weight 225.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[chloro(difluoro)methyl]-4,4,4-trifluoro-3-hydroxybutanal
Also Known As: 4-Chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)butyraldehyde, 3-[chloro(difluoro)methyl]-4,4,4-trifluoro-3-hydroxybutanal, Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)-, 3-(CHLORO-DIFLUORO-METHYL)-4,4,4-TRIFLUORO-3-HYDROXY-BUTANAL, Butanal,4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)-
| Molecular Formula | C5H4ClF5O2 |
|---|---|
| Molecular Weight | 225.98 g/mol |
| LogP | 1.7004 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.982 |
| Heavy Atoms | 13 |
| Complexity | 182.08188 |
Chemical Identifiers
| CAS Number | 100482-83-5 |
|---|---|
| SMILES | C(C=O)C(C(F)(F)F)(C(F)(F)Cl)O |
Product Overview
Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)- (CAS 100482-83-5), with molecular formula C5H4ClF5O2 and molecular weight 225.98 g/mol. IUPAC: 3-[chloro(difluoro)methyl]-4,4,4-trifluoro-3-hydroxybutanal.
Chemical Property Profile of Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)-
Property Insights of Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)-
The XLogP value of 1.7004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)-. With a topological polar surface area (TPSA) of 37.3 Ų, Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)- has 1 hydrogen bond donor(s) and 2 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 Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)-?
The CAS number of Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)- is 100482-83-5.
What is the molecular formula of Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)-?
The molecular formula of Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)- is C5H4ClF5O2.
What is the molecular weight of Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)-?
The molecular weight of Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)- is 225.98 g/mol.
Where can I buy Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)-?
You can request a quote for Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Butyraldehyde, 4-chloro-4,4-difluoro-3-hydroxy-3-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.