O-Chlorophenolindophenol
TL;DR: O-Chlorophenolindophenol (CAS 5418-31-5) is a chemical compound with molecular formula C12H8ClNO2 and molecular weight 233.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-chloro-4-hydroxyphenyl)iminocyclohexa-2,5-dien-1-one
Also Known As: 2-Chlorindophenol, O-CHLOROPHENOLINDOPHENOL, 4-(3-chloro-4-hydroxyphenyl)iminocyclohexa-2,5-dien-1-one, J1.406.105C, N-(3-Chloro-4-hydroxyphenyl)-p-benzoquinone monoimine
| Molecular Formula | C12H8ClNO2 |
|---|---|
| Molecular Weight | 233.02 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 233.02435 |
| Heavy Atoms | 16 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 5418-31-5 |
|---|---|
| SMILES | C1=CC(=O)C=CC1=NC2=CC(=C(C=C2)O)Cl |
| InChIKey | RNIWVTZQQMUZAJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
O-Chlorophenolindophenol (CAS 5418-31-5), with molecular formula C12H8ClNO2 and molecular weight 233.02 g/mol. IUPAC: 4-(3-chloro-4-hydroxyphenyl)iminocyclohexa-2,5-dien-1-one.
Chemical Property Profile of O-Chlorophenolindophenol
Property Insights of O-Chlorophenolindophenol
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-Chlorophenolindophenol. With a topological polar surface area (TPSA) of 49.7 Ų, O-Chlorophenolindophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-Chlorophenolindophenol has 1 hydrogen bond donor(s) and 3 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 O-Chlorophenolindophenol?
The CAS number of O-Chlorophenolindophenol is 5418-31-5.
What is the molecular formula of O-Chlorophenolindophenol?
The molecular formula of O-Chlorophenolindophenol is C12H8ClNO2.
What is the molecular weight of O-Chlorophenolindophenol?
The molecular weight of O-Chlorophenolindophenol is 233.02 g/mol.
Where can I buy O-Chlorophenolindophenol?
You can request a quote for O-Chlorophenolindophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-Chlorophenolindophenol?
Yes, KEHONG BIO provides custom synthesis services for O-Chlorophenolindophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.