2-(3,4-Dichlorophenyl)ethanol
TL;DR: 2-(3,4-Dichlorophenyl)ethanol (CAS 4013-24-5) is a chemical compound with molecular formula C8H8Cl2O and molecular weight 190.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dichlorophenyl)ethanol
Also Known As: 2-(3,4-Dichlorophenyl)ethanol, 3,4-Dichlorophenethyl Alcohol, benzeneethanol, 3,4-dichloro-, 3,4-dichlorophenethylalcohol, 2-(3,4-dichlorophenyl)ethan-1-ol
| Molecular Formula | C8H8Cl2O |
|---|---|
| Molecular Weight | 190.00 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.99522 |
| Heavy Atoms | 11 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 4013-24-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1CCO)Cl)Cl |
| InChIKey | GITOMJDYNUMCOV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(3,4-Dichlorophenyl)ethanol (CAS 4013-24-5), with molecular formula C8H8Cl2O and molecular weight 190.00 g/mol. IUPAC: 2-(3,4-dichlorophenyl)ethanol.
Chemical Property Profile of 2-(3,4-Dichlorophenyl)ethanol
Property Insights of 2-(3,4-Dichlorophenyl)ethanol
The XLogP value of 3.2 indicates that 2-(3,4-Dichlorophenyl)ethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2-(3,4-Dichlorophenyl)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-Dichlorophenyl)ethanol has 1 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-(3,4-Dichlorophenyl)ethanol?
The CAS number of 2-(3,4-Dichlorophenyl)ethanol is 4013-24-5.
What is the molecular formula of 2-(3,4-Dichlorophenyl)ethanol?
The molecular formula of 2-(3,4-Dichlorophenyl)ethanol is C8H8Cl2O.
What is the molecular weight of 2-(3,4-Dichlorophenyl)ethanol?
The molecular weight of 2-(3,4-Dichlorophenyl)ethanol is 190.00 g/mol.
Where can I buy 2-(3,4-Dichlorophenyl)ethanol?
You can request a quote for 2-(3,4-Dichlorophenyl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dichlorophenyl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dichlorophenyl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.