4-Bromonaphthyl 4-phenylbenzoate
TL;DR: 4-Bromonaphthyl 4-phenylbenzoate (CAS 445409-00-7) is a chemical compound with molecular formula C23H15BrO2 and molecular weight 402.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromonaphthalen-1-yl) 4-phenylbenzoate
Also Known As: 4-bromonaphthyl 4-phenylbenzoate, 4-bromo-1-naphthyl 4-biphenylcarboxylate, (4-bromonaphthalen-1-yl) 4-phenylbenzoate, 4-bromonaphthalen-1-yl biphenyl-4-carboxylate, 4-Bromo-1-naphthalenyl [1,1'-biphenyl]-4-carboxylate
| Molecular Formula | C23H15BrO2 |
|---|---|
| Molecular Weight | 402.03 g/mol |
| LogP | 6.4885 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.02554 |
| Heavy Atoms | 26 |
| Complexity | 1070.3196 |
Chemical Identifiers
| CAS Number | 445409-00-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C4=CC=CC=C43)Br |
Product Overview
4-Bromonaphthyl 4-phenylbenzoate (CAS 445409-00-7), with molecular formula C23H15BrO2 and molecular weight 402.03 g/mol. IUPAC: (4-bromonaphthalen-1-yl) 4-phenylbenzoate.
Chemical Property Profile of 4-Bromonaphthyl 4-phenylbenzoate
Property Insights of 4-Bromonaphthyl 4-phenylbenzoate
The XLogP value of 6.4885 indicates that 4-Bromonaphthyl 4-phenylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4-Bromonaphthyl 4-phenylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromonaphthyl 4-phenylbenzoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Bromonaphthyl 4-phenylbenzoate?
The CAS number of 4-Bromonaphthyl 4-phenylbenzoate is 445409-00-7.
What is the molecular formula of 4-Bromonaphthyl 4-phenylbenzoate?
The molecular formula of 4-Bromonaphthyl 4-phenylbenzoate is C23H15BrO2.
What is the molecular weight of 4-Bromonaphthyl 4-phenylbenzoate?
The molecular weight of 4-Bromonaphthyl 4-phenylbenzoate is 402.03 g/mol.
Where can I buy 4-Bromonaphthyl 4-phenylbenzoate?
You can request a quote for 4-Bromonaphthyl 4-phenylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromonaphthyl 4-phenylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromonaphthyl 4-phenylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.