[(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
TL;DR: [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate (CAS 101858-98-4) is a chemical compound with molecular formula C18H22Cl2O3 and molecular weight 356.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
Also Known As: [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate|Benzoic acid, 2,4-dichloro-, 5-(2-hydroxycyclohexyl)-2-pentenyl ester, (1alpha(Z),2beta)-|Benzoic acid, 2,4-dichloro-, 5-(2-hydroxycyclohexyl)-2-pentenyl ester, (1alpha(Z),2beta)-
| Molecular Formula | C18H22Cl2O3 |
|---|---|
| Molecular Weight | 356.09 g/mol |
| LogP | 5.0377 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.0946 |
| Heavy Atoms | 23 |
| Complexity | 557.1977 |
Chemical Identifiers
| CAS Number | 101858-98-4 |
|---|---|
| SMILES | C1CC[C@@H]([C@H](C1)CC/C=C\COC(=O)C2=C(C=C(C=C2)Cl)Cl)O |
Product Overview
[(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate (CAS 101858-98-4), with molecular formula C18H22Cl2O3 and molecular weight 356.09 g/mol. IUPAC: [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate.
Chemical Property Profile of [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
Property Insights of [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate
The XLogP value of 5.0377 indicates that [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate?
The CAS number of [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate is 101858-98-4.
What is the molecular formula of [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate?
The molecular formula of [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate is C18H22Cl2O3.
What is the molecular weight of [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate?
The molecular weight of [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate is 356.09 g/mol.
Where can I buy [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate?
You can request a quote for [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [(Z)-5-[(1R,2S)-2-hydroxycyclohexyl]pent-2-enyl] 2,4-dichlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.