1,1,2-Trichloro-3,3,3-trifluoro-1-propene
TL;DR: 1,1,2-Trichloro-3,3,3-trifluoro-1-propene (CAS 431-52-7) is a chemical compound with molecular formula C3Cl3F3 and molecular weight 197.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,2-trichloro-3,3,3-trifluoroprop-1-ene
Also Known As: 1,1,2-Trichloro-3,3,3-trifluoropropene, 1,1,2-trichloro-3,3,3-trifluoroprop-1-ene, TCTFP, C3Cl3F3, trifluorotrichloropropene
| Molecular Formula | C3Cl3F3 |
|---|---|
| Molecular Weight | 197.90 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 197.90176 |
| Heavy Atoms | 9 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 431-52-7 |
|---|---|
| SMILES | C(=C(Cl)Cl)(C(F)(F)F)Cl |
| InChIKey | QSSVZVNYQIGOJR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,2-Trichloro-3,3,3-trifluoro-1-propene (CAS 431-52-7), with molecular formula C3Cl3F3 and molecular weight 197.90 g/mol. IUPAC: 1,1,2-trichloro-3,3,3-trifluoroprop-1-ene.
Chemical Property Profile of 1,1,2-Trichloro-3,3,3-trifluoro-1-propene
Property Insights of 1,1,2-Trichloro-3,3,3-trifluoro-1-propene
The XLogP value of 3.5 indicates that 1,1,2-Trichloro-3,3,3-trifluoro-1-propene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1,2-Trichloro-3,3,3-trifluoro-1-propene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,2-Trichloro-3,3,3-trifluoro-1-propene has 0 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 1,1,2-Trichloro-3,3,3-trifluoro-1-propene?
The CAS number of 1,1,2-Trichloro-3,3,3-trifluoro-1-propene is 431-52-7.
What is the molecular formula of 1,1,2-Trichloro-3,3,3-trifluoro-1-propene?
The molecular formula of 1,1,2-Trichloro-3,3,3-trifluoro-1-propene is C3Cl3F3.
What is the molecular weight of 1,1,2-Trichloro-3,3,3-trifluoro-1-propene?
The molecular weight of 1,1,2-Trichloro-3,3,3-trifluoro-1-propene is 197.90 g/mol.
Where can I buy 1,1,2-Trichloro-3,3,3-trifluoro-1-propene?
You can request a quote for 1,1,2-Trichloro-3,3,3-trifluoro-1-propene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,2-Trichloro-3,3,3-trifluoro-1-propene?
Yes, KEHONG BIO provides custom synthesis services for 1,1,2-Trichloro-3,3,3-trifluoro-1-propene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.