3-Chloro-1,1,2,3,3-pentafluoro-1-propene
TL;DR: 3-Chloro-1,1,2,3,3-pentafluoro-1-propene (CAS 79-47-0) is a chemical compound with molecular formula C3ClF5 and molecular weight 165.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-1,1,2,3,3-pentafluoroprop-1-ene
Also Known As: Perfluoroallyl chloride, 3-Chloropentafluoropropene, 1-Propene, 3-chloro-1,1,2,3,3-pentafluoro-, Pentafluoroallyl chloride, C3ClF5
| Molecular Formula | C3ClF5 |
|---|---|
| Molecular Weight | 165.96 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 165.96086 |
| Heavy Atoms | 9 |
| Complexity | 135.0 |
Chemical Identifiers
| CAS Number | 79-47-0 |
|---|---|
| SMILES | C(=C(F)F)(C(F)(F)Cl)F |
| InChIKey | IJTAKAGEJXIJPQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Chloro-1,1,2,3,3-pentafluoro-1-propene (CAS 79-47-0), with molecular formula C3ClF5 and molecular weight 165.96 g/mol. IUPAC: 3-chloro-1,1,2,3,3-pentafluoroprop-1-ene.
Chemical Property Profile of 3-Chloro-1,1,2,3,3-pentafluoro-1-propene
Property Insights of 3-Chloro-1,1,2,3,3-pentafluoro-1-propene
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-1,1,2,3,3-pentafluoro-1-propene. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Chloro-1,1,2,3,3-pentafluoro-1-propene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-1,1,2,3,3-pentafluoro-1-propene has 0 hydrogen bond donor(s) and 5 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 3-Chloro-1,1,2,3,3-pentafluoro-1-propene?
The CAS number of 3-Chloro-1,1,2,3,3-pentafluoro-1-propene is 79-47-0.
What is the molecular formula of 3-Chloro-1,1,2,3,3-pentafluoro-1-propene?
The molecular formula of 3-Chloro-1,1,2,3,3-pentafluoro-1-propene is C3ClF5.
What is the molecular weight of 3-Chloro-1,1,2,3,3-pentafluoro-1-propene?
The molecular weight of 3-Chloro-1,1,2,3,3-pentafluoro-1-propene is 165.96 g/mol.
Where can I buy 3-Chloro-1,1,2,3,3-pentafluoro-1-propene?
You can request a quote for 3-Chloro-1,1,2,3,3-pentafluoro-1-propene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-1,1,2,3,3-pentafluoro-1-propene?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-1,1,2,3,3-pentafluoro-1-propene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.