2,3,3-三氯丙烯酰氯
TL;DR: 2,3,3-三氯丙烯酰氯 (CAS 815-58-7) is a chemical compound with molecular formula C3Cl4O and molecular weight 191.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,3-三氯丙烯酰氯
2,3,3-trichloroprop-2-enoyl chloride
Also Known As: 2,3,3-Trichloroacryloyl chloride, Trichloroacryloyl chloride, TCAT, Trichloracrylyl chloride, Trichloroacrylyl chloride
| Molecular Formula | C3Cl4O |
|---|---|
| Molecular Weight | 191.87 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.86737 |
| Heavy Atoms | 8 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 815-58-7 |
|---|---|
| SMILES | C(=C(Cl)Cl)(C(=O)Cl)Cl |
| InChIKey | BCOSEZGCLGPUSL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,3-三氯丙烯酰氯 (CAS 815-58-7), with molecular formula C3Cl4O and molecular weight 191.87 g/mol. IUPAC: 2,3,3-trichloroprop-2-enoyl chloride.
Chemical Property Profile of 2,3,3-三氯丙烯酰氯
Property Insights of 2,3,3-三氯丙烯酰氯
The XLogP value of 3.3 indicates that 2,3,3-三氯丙烯酰氯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2,3,3-三氯丙烯酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,3-三氯丙烯酰氯 has 0 hydrogen bond donor(s) and 1 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 2,3,3-三氯丙烯酰氯?
The CAS number of 2,3,3-三氯丙烯酰氯 is 815-58-7.
What is the molecular formula of 2,3,3-三氯丙烯酰氯?
The molecular formula of 2,3,3-三氯丙烯酰氯 is C3Cl4O.
What is the molecular weight of 2,3,3-三氯丙烯酰氯?
The molecular weight of 2,3,3-三氯丙烯酰氯 is 191.87 g/mol.
Where can I buy 2,3,3-三氯丙烯酰氯?
You can request a quote for 2,3,3-三氯丙烯酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,3-三氯丙烯酰氯?
Yes, KEHONG BIO provides custom synthesis services for 2,3,3-三氯丙烯酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.