3-Chlorocyclohexa-3,5-diene-1,2-diol
TL;DR: 3-Chlorocyclohexa-3,5-diene-1,2-diol (CAS 65986-73-4) is a chemical compound with molecular formula C6H7ClO2 and molecular weight 146.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chlorocyclohexa-3,5-diene-1,2-diol
Also Known As: (1S,2S)-3-Chlorocyclohexa-3,5-diene-1,2-diol, 3-chlorocyclohexa-3,5-diene-1,2-diol, (1S,2S)-3-Chloro-3,5-cyclohexadiene-1,2-diol
| Molecular Formula | C6H7ClO2 |
|---|---|
| Molecular Weight | 146.01 g/mol |
| LogP | 0.4007 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 146.01346 |
| Heavy Atoms | 9 |
| Complexity | 162.4408 |
Chemical Identifiers
| CAS Number | 65986-73-4 |
|---|---|
| SMILES | C1=CC(C(C(=C1)Cl)O)O |
Product Overview
3-Chlorocyclohexa-3,5-diene-1,2-diol (CAS 65986-73-4), with molecular formula C6H7ClO2 and molecular weight 146.01 g/mol. IUPAC: 3-chlorocyclohexa-3,5-diene-1,2-diol.
Chemical Property Profile of 3-Chlorocyclohexa-3,5-diene-1,2-diol
Property Insights of 3-Chlorocyclohexa-3,5-diene-1,2-diol
The XLogP value of 0.4007 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chlorocyclohexa-3,5-diene-1,2-diol. With a topological polar surface area (TPSA) of 40.46 Ų, 3-Chlorocyclohexa-3,5-diene-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chlorocyclohexa-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 3-Chlorocyclohexa-3,5-diene-1,2-diol?
The CAS number of 3-Chlorocyclohexa-3,5-diene-1,2-diol is 65986-73-4.
What is the molecular formula of 3-Chlorocyclohexa-3,5-diene-1,2-diol?
The molecular formula of 3-Chlorocyclohexa-3,5-diene-1,2-diol is C6H7ClO2.
What is the molecular weight of 3-Chlorocyclohexa-3,5-diene-1,2-diol?
The molecular weight of 3-Chlorocyclohexa-3,5-diene-1,2-diol is 146.01 g/mol.
Where can I buy 3-Chlorocyclohexa-3,5-diene-1,2-diol?
You can request a quote for 3-Chlorocyclohexa-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 3-Chlorocyclohexa-3,5-diene-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for 3-Chlorocyclohexa-3,5-diene-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.