双氯酚
TL;DR: 双氯酚 (CAS 97-23-4) is a chemical compound with molecular formula C13H10Cl2O2 and molecular weight 268.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双氯酚
4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol
Also Known As: Dichlorophen, dichlorophene, Didroxane, Anthiphen, Parabis
| Molecular Formula | C13H10Cl2O2 |
|---|---|
| Molecular Weight | 268.01 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.0058 |
| Heavy Atoms | 17 |
| Complexity | 226.0 |
| Melting Point | 351 to 177.8 °C |
| Solubility | less than 1 mg/mL at 72 °F (NTP, 1992) |
| Vapor Pressure | 1e-10 mmHg at 25.0 °C ; 0.0001 mmHg at 100.0 °C |
Chemical Identifiers
| CAS Number | 97-23-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)CC2=C(C=CC(=C2)Cl)O)O |
| InChIKey | MDNWOSOZYLHTCG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
双氯酚 (CAS 97-23-4), with molecular formula C13H10Cl2O2 and molecular weight 268.01 g/mol. IUPAC: 4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol.
Chemical Property Profile of 双氯酚
Property Insights of 双氯酚
The XLogP value of 4.3 indicates that Dichlorophen is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 双氯酚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dichlorophen 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 Dichlorophen?
The CAS number of Dichlorophen is 97-23-4.
What is the molecular formula of Dichlorophen?
The molecular formula of Dichlorophen is C13H10Cl2O2.
What is the molecular weight of Dichlorophen?
The molecular weight of Dichlorophen is 268.01 g/mol.
Where can I buy Dichlorophen?
You can request a quote for Dichlorophen directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dichlorophen?
Yes, KEHONG BIO provides custom synthesis services for Dichlorophen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.