4-Formylphenyl 4-bromobenzoate
TL;DR: 4-Formylphenyl 4-bromobenzoate (CAS 329694-40-8) is a chemical compound with molecular formula C14H9BrO3 and molecular weight 303.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-formylphenyl) 4-bromobenzoate
Also Known As: 4-formylphenyl 4-bromobenzoate, (4-formylphenyl) 4-bromobenzoate, A3064/0129510
| Molecular Formula | C14H9BrO3 |
|---|---|
| Molecular Weight | 303.97 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.9735 |
| Heavy Atoms | 18 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 329694-40-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C=O)OC(=O)C2=CC=C(C=C2)Br |
| InChIKey | HDWKZYMDAIYCIM-UHFFFAOYSA-N |
Product Overview
4-Formylphenyl 4-bromobenzoate (CAS 329694-40-8), with molecular formula C14H9BrO3 and molecular weight 303.97 g/mol. IUPAC: (4-formylphenyl) 4-bromobenzoate.
Chemical Property Profile of 4-Formylphenyl 4-bromobenzoate
Property Insights of 4-Formylphenyl 4-bromobenzoate
The XLogP value of 3.7 indicates that 4-Formylphenyl 4-bromobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 4-Formylphenyl 4-bromobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Formylphenyl 4-bromobenzoate 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 4-Formylphenyl 4-bromobenzoate?
The CAS number of 4-Formylphenyl 4-bromobenzoate is 329694-40-8.
What is the molecular formula of 4-Formylphenyl 4-bromobenzoate?
The molecular formula of 4-Formylphenyl 4-bromobenzoate is C14H9BrO3.
What is the molecular weight of 4-Formylphenyl 4-bromobenzoate?
The molecular weight of 4-Formylphenyl 4-bromobenzoate is 303.97 g/mol.
Where can I buy 4-Formylphenyl 4-bromobenzoate?
You can request a quote for 4-Formylphenyl 4-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Formylphenyl 4-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-Formylphenyl 4-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.