![2-[(Pentachlorophenyl)amino]ethanol structure](/static/products/6642/6642-45-1.webp)
2-[(Pentachlorophenyl)amino]ethanol
TL;DR: 2-[(Pentachlorophenyl)amino]ethanol (CAS 6642-45-1) is a chemical compound with molecular formula C8H6Cl5NO and molecular weight 306.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3,4,5,6-pentachloroanilino)ethanol
Also Known As: 2-[(pentachlorophenyl)amino]ethanol, 2-(Pentachloroanilino)ethan-1-ol, 2-(2,3,4,5,6-pentachloroanilino)ethanol
| Molecular Formula | C8H6Cl5NO |
|---|---|
| Molecular Weight | 306.89 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.8892 |
| Heavy Atoms | 15 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 6642-45-1 |
|---|---|
| SMILES | C(CO)NC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl |
| InChIKey | GFIWWODRDJUREQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(Pentachlorophenyl)amino]ethanol (CAS 6642-45-1), with molecular formula C8H6Cl5NO and molecular weight 306.89 g/mol. IUPAC: 2-(2,3,4,5,6-pentachloroanilino)ethanol.
Chemical Property Profile of 2-[(Pentachlorophenyl)amino]ethanol
Property Insights of 2-[(Pentachlorophenyl)amino]ethanol
The XLogP value of 4.4 indicates that 2-[(Pentachlorophenyl)amino]ethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 2-[(Pentachlorophenyl)amino]ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(Pentachlorophenyl)amino]ethanol has 2 hydrogen bond donor(s) and 2 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-[(Pentachlorophenyl)amino]ethanol?
The CAS number of 2-[(Pentachlorophenyl)amino]ethanol is 6642-45-1.
What is the molecular formula of 2-[(Pentachlorophenyl)amino]ethanol?
The molecular formula of 2-[(Pentachlorophenyl)amino]ethanol is C8H6Cl5NO.
What is the molecular weight of 2-[(Pentachlorophenyl)amino]ethanol?
The molecular weight of 2-[(Pentachlorophenyl)amino]ethanol is 306.89 g/mol.
Where can I buy 2-[(Pentachlorophenyl)amino]ethanol?
You can request a quote for 2-[(Pentachlorophenyl)amino]ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Pentachlorophenyl)amino]ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Pentachlorophenyl)amino]ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.