![[(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate structure](/static/products/995/99566-46-8.png)
[(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate
TL;DR: [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate (CAS 99566-46-8) is a chemical compound with molecular formula C25H23BrO3 and molecular weight 450.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate
Also Known As: [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate|Benzoic acid, 4-bromo-, 1-ethyl-2-methyl-3-(3-phenoxyphenyl)-2-propenyl ester, (R-(E))-
| Molecular Formula | C25H23BrO3 |
|---|---|
| Molecular Weight | 450.08 g/mol |
| LogP | 7.2803 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 450.08307 |
| Heavy Atoms | 29 |
| Complexity | 978.465 |
Chemical Identifiers
| CAS Number | 99566-46-8 |
|---|---|
| SMILES | CC[C@H](/C(=C/C1=CC(=CC=C1)OC2=CC=CC=C2)/C)OC(=O)C3=CC=C(C=C3)Br |
Product Overview
[(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate (CAS 99566-46-8), with molecular formula C25H23BrO3 and molecular weight 450.08 g/mol. IUPAC: [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate.
Chemical Property Profile of [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate
Property Insights of [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate
The XLogP value of 7.2803 indicates that [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate has 0 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 [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate?
The CAS number of [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate is 99566-46-8.
What is the molecular formula of [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate?
The molecular formula of [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate is C25H23BrO3.
What is the molecular weight of [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate?
The molecular weight of [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate is 450.08 g/mol.
Where can I buy [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate?
You can request a quote for [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [(E,3R)-2-methyl-1-(3-phenoxyphenyl)pent-1-en-3-yl] 4-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.