![methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate structure](/static/products/1019/101976-96-9.webp)
methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate
TL;DR: methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate (CAS 101976-96-9) is a chemical compound with molecular formula C19H25BrO3 and molecular weight 380.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate
Also Known As: 2-Pentenoic acid, 5-(2-((4-bromophenyl)methoxy)cyclohexyl)-, methyl ester, (1alpha(E),2beta)-, 2-Pentenoic acid, 5-(2-((4-bromophenyl)methoxy)cyclohexyl)-, methyl ester, (1alpha(Z),2beta)-, 2-Pentenoic acid,5-[2-[(4-bromophenyl)methoxy]cyclohexyl]-, methyl ester, [1a(E),2b]- (9CI), 2-Pentenoic acid,5-[2-[(4-bromophenyl)methoxy]cyclohexyl]-, methyl ester, [1a(Z),2b]- (9CI)
| Molecular Formula | C19H25BrO3 |
|---|---|
| Molecular Weight | 380.10 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 380.09872 |
| Heavy Atoms | 23 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 101976-96-9 |
|---|---|
| SMILES | COC(=O)C=CCC[C@H]1CCCC[C@@H]1OCC2=CC=C(C=C2)Br |
| InChIKey | AVIQLVPJIUFUTF-AEFFLSMTSA-N |
Product Overview
methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate (CAS 101976-96-9), with molecular formula C19H25BrO3 and molecular weight 380.10 g/mol. IUPAC: methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate.
Chemical Property Profile of methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate
Property Insights of methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate
The XLogP value of 4.9 indicates that methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate has 0 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 methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate?
The CAS number of methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate is 101976-96-9.
What is the molecular formula of methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate?
The molecular formula of methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate is C19H25BrO3.
What is the molecular weight of methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate?
The molecular weight of methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate is 380.10 g/mol.
Where can I buy methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate?
You can request a quote for methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.