1,2,3-Trichloro-1-propene
TL;DR: 1,2,3-Trichloro-1-propene (CAS 96-19-5) is a chemical compound with molecular formula C3H3Cl3 and molecular weight 143.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3-trichloroprop-1-ene
Also Known As: 1,2,3-Trichloropropene, 1,2,3-trichloroprop-1-ene, 1,2,3-trichloropropyl, 1,2,3-TRICHLORO-1-PROPENE, 1-Propene, 1,2,3-trichloro-
| Molecular Formula | C3H3Cl3 |
|---|---|
| Molecular Weight | 143.93 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 143.93004 |
| Heavy Atoms | 6 |
| Complexity | 57.0 |
| Boiling Point | 142 °C |
| Density | 1.412 @ 20 °C/20 °C |
| Solubility | VERY SOL IN CHLOROFORM |
| Flash Point | 85 °C |
| Vapor Pressure | 4.4 [mmHg] |
| Refractive Index | 1.5030 @ 20 °C |
Chemical Identifiers
| CAS Number | 96-19-5 |
|---|---|
| SMILES | C(C(=CCl)Cl)Cl |
| InChIKey | HIILBTHBHCLUER-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3-Trichloro-1-propene (CAS 96-19-5), with molecular formula C3H3Cl3 and molecular weight 143.93 g/mol. IUPAC: 1,2,3-trichloroprop-1-ene.
Chemical Property Profile of 1,2,3-Trichloro-1-propene
Property Insights of 1,2,3-Trichloro-1-propene
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3-Trichloro-1-propene. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2,3-Trichloro-1-propene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3-Trichloro-1-propene has 0 hydrogen bond donor(s) and 0 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 1,2,3-Trichloro-1-propene?
The CAS number of 1,2,3-Trichloro-1-propene is 96-19-5.
What is the molecular formula of 1,2,3-Trichloro-1-propene?
The molecular formula of 1,2,3-Trichloro-1-propene is C3H3Cl3.
What is the molecular weight of 1,2,3-Trichloro-1-propene?
The molecular weight of 1,2,3-Trichloro-1-propene is 143.93 g/mol.
Where can I buy 1,2,3-Trichloro-1-propene?
You can request a quote for 1,2,3-Trichloro-1-propene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3-Trichloro-1-propene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3-Trichloro-1-propene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.