2,5-二氯苯酚
TL;DR: 2,5-二氯苯酚 (CAS 583-78-8) is a chemical compound with molecular formula C6H4Cl2O and molecular weight 161.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-二氯苯酚
2,5-dichlorophenol
Also Known As: 2,5-dichlorophenol, Phenol, 2,5-dichloro-, 2,5-dichloro-phenol, 4-methyltropolone, 3,6-dichlorophenol
| Molecular Formula | C6H4Cl2O |
|---|---|
| Molecular Weight | 161.96 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 161.96391 |
| Heavy Atoms | 9 |
| Complexity | 97.0 |
| Melting Point | 133 to 57.8 °C |
| Boiling Point | 211.1 °C at 760 mmHg |
| Density | Relative density of the vapour/air-mixture at 20 °C (air = 1): 1.00 |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
| Vapor Pressure | 0.06 [mmHg] |
Chemical Identifiers
| CAS Number | 583-78-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)O)Cl |
| InChIKey | RANCECPPZPIPNO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-二氯苯酚 (CAS 583-78-8), with molecular formula C6H4Cl2O and molecular weight 161.96 g/mol. IUPAC: 2,5-dichlorophenol.
Chemical Property Profile of 2,5-二氯苯酚
Property Insights of 2,5-二氯苯酚
The XLogP value of 3.1 indicates that 2,5-二氯苯酚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2,5-二氯苯酚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-二氯苯酚 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 2,5-二氯苯酚?
The CAS number of 2,5-二氯苯酚 is 583-78-8.
What is the molecular formula of 2,5-二氯苯酚?
The molecular formula of 2,5-二氯苯酚 is C6H4Cl2O.
What is the molecular weight of 2,5-二氯苯酚?
The molecular weight of 2,5-二氯苯酚 is 161.96 g/mol.
Where can I buy 2,5-二氯苯酚?
You can request a quote for 2,5-二氯苯酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-二氯苯酚?
Yes, KEHONG BIO provides custom synthesis services for 2,5-二氯苯酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.