3,4,6-Trichloro-2-propylphenol
TL;DR: 3,4,6-Trichloro-2-propylphenol (CAS 55538-73-3) is a chemical compound with molecular formula C9H9Cl3O and molecular weight 237.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,6-trichloro-2-propylphenol
Also Known As: 3,4,6-Trichloro-2-propylphenol, Phenol, 3,4,6-trichloro-2-propyl-, 3,4,6-Trichloro-2-propylphenol #
| Molecular Formula | C9H9Cl3O |
|---|---|
| Molecular Weight | 237.97 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.9719 |
| Heavy Atoms | 13 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 55538-73-3 |
|---|---|
| SMILES | CCCC1=C(C(=CC(=C1Cl)Cl)Cl)O |
| InChIKey | MXYBGBYJNHYRSG-UHFFFAOYSA-N |
Product Overview
3,4,6-Trichloro-2-propylphenol (CAS 55538-73-3), with molecular formula C9H9Cl3O and molecular weight 237.97 g/mol. IUPAC: 3,4,6-trichloro-2-propylphenol.
Chemical Property Profile of 3,4,6-Trichloro-2-propylphenol
Property Insights of 3,4,6-Trichloro-2-propylphenol
The XLogP value of 5.4 indicates that 3,4,6-Trichloro-2-propylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 3,4,6-Trichloro-2-propylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,6-Trichloro-2-propylphenol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4,6-Trichloro-2-propylphenol?
The CAS number of 3,4,6-Trichloro-2-propylphenol is 55538-73-3.
What is the molecular formula of 3,4,6-Trichloro-2-propylphenol?
The molecular formula of 3,4,6-Trichloro-2-propylphenol is C9H9Cl3O.
What is the molecular weight of 3,4,6-Trichloro-2-propylphenol?
The molecular weight of 3,4,6-Trichloro-2-propylphenol is 237.97 g/mol.
Where can I buy 3,4,6-Trichloro-2-propylphenol?
You can request a quote for 3,4,6-Trichloro-2-propylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,6-Trichloro-2-propylphenol?
Yes, KEHONG BIO provides custom synthesis services for 3,4,6-Trichloro-2-propylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.