rel-(1R,2R)-2-Chlorocyclohexanol
TL;DR: rel-(1R,2R)-2-Chlorocyclohexanol (CAS 6628-80-4) is a chemical compound with molecular formula C6H11ClO and molecular weight 134.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(1R,2R)-2-chlorocyclohexan-1-ol
Also Known As: trans-2-Chlorocyclohexanol, Cyclohexanol, trans-, 2-CHLOROPHENOL, (1r,2r)-2-chlorocyclohexanol, trans-2-Chlorcyclohexanol
| Molecular Formula | C6H11ClO |
|---|---|
| Molecular Weight | 134.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 134.04984 |
| Heavy Atoms | 8 |
| Complexity | 74.0 |
| Melting Point | 29 °C |
| Boiling Point | 93 °C @760 [mm Hg] |
Chemical Identifiers
| CAS Number | 6628-80-4 |
|---|---|
| SMILES | C1CC[C@H]([C@@H](C1)O)Cl |
| InChIKey | NYEWDMNOXFGGDX-PHDIDXHHSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
rel-(1R,2R)-2-Chlorocyclohexanol (CAS 6628-80-4), with molecular formula C6H11ClO and molecular weight 134.05 g/mol. IUPAC: trans-(1R,2R)-2-chlorocyclohexan-1-ol.
Chemical Property Profile of rel-(1R,2R)-2-Chlorocyclohexanol
Property Insights of rel-(1R,2R)-2-Chlorocyclohexanol
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for rel-(1R,2R)-2-Chlorocyclohexanol. With a topological polar surface area (TPSA) of 20.2 Ų, rel-(1R,2R)-2-Chlorocyclohexanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, rel-(1R,2R)-2-Chlorocyclohexanol 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 rel-(1R,2R)-2-Chlorocyclohexanol?
The CAS number of rel-(1R,2R)-2-Chlorocyclohexanol is 6628-80-4.
What is the molecular formula of rel-(1R,2R)-2-Chlorocyclohexanol?
The molecular formula of rel-(1R,2R)-2-Chlorocyclohexanol is C6H11ClO.
What is the molecular weight of rel-(1R,2R)-2-Chlorocyclohexanol?
The molecular weight of rel-(1R,2R)-2-Chlorocyclohexanol is 134.05 g/mol.
Where can I buy rel-(1R,2R)-2-Chlorocyclohexanol?
You can request a quote for rel-(1R,2R)-2-Chlorocyclohexanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for rel-(1R,2R)-2-Chlorocyclohexanol?
Yes, KEHONG BIO provides custom synthesis services for rel-(1R,2R)-2-Chlorocyclohexanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.