4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol
TL;DR: 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol (CAS 98518-03-7) is a chemical compound with molecular formula C12H11ClO2 and molecular weight 222.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)cyclohexa-3,5-diene-1,2-diol
Also Known As: 4-(4-chlorophenyl)cyclohexa-3,5-diene-1,2-diol, 3-(4-chlorophenyl)cyclohexa-2,4-diene-1,6-diol, 4'-Chloro-3,4-dihydro[1,1'-biphenyl]-3,4-diol, 4'-Chloro-3,4-dihydro-[1,1'-biphenyl]-3,4-diol, 98518-03-7, AC1L42AV, 3-(4-chlorophenyl)cyclohexa-2,4-diene-1,6-diol, CTK3I8166, 4-(4-chlorophenyl)cyclohexa-3,5-diene-1,2-diol
| Molecular Formula | C12H11ClO2 |
|---|---|
| Molecular Weight | 222.04 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.04475 |
| Heavy Atoms | 15 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 98518-03-7 |
|---|---|
| SMILES | C1=CC(=CC(C1O)O)C2=CC=C(C=C2)Cl |
| InChIKey | MHAHKEBAMPPKLG-UHFFFAOYSA-N |
Product Overview
4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol (CAS 98518-03-7), with molecular formula C12H11ClO2 and molecular weight 222.04 g/mol. IUPAC: 4-(4-chlorophenyl)cyclohexa-3,5-diene-1,2-diol.
Chemical Property Profile of 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol
Property Insights of 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol. With a topological polar surface area (TPSA) of 40.5 Ų, 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol 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 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol?
The CAS number of 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol is 98518-03-7.
What is the molecular formula of 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol?
The molecular formula of 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol is C12H11ClO2.
What is the molecular weight of 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol?
The molecular weight of 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol is 222.04 g/mol.
Where can I buy 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol?
You can request a quote for 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Chlorophenyl)cyclohexa-3,5-diene-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.