Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester
TL;DR: Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester (CAS 88486-53-7) is a chemical compound with molecular formula C14H11BrO3 and molecular weight 305.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)methyl 3-hydroxybenzoate
Also Known As: (4-bromophenyl)methyl 3-hydroxybenzoate, 1-Benzolsulfonyl-2-chlor-1-octen, Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester, AB01330057-02
| Molecular Formula | C14H11BrO3 |
|---|---|
| Molecular Weight | 305.99 g/mol |
| LogP | 3.5117 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.98917 |
| Heavy Atoms | 18 |
| Complexity | 549.2205 |
Chemical Identifiers
| CAS Number | 88486-53-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)O)C(=O)OCC2=CC=C(C=C2)Br |
Product Overview
Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester (CAS 88486-53-7), with molecular formula C14H11BrO3 and molecular weight 305.99 g/mol. IUPAC: (4-bromophenyl)methyl 3-hydroxybenzoate.
Chemical Property Profile of Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester
Property Insights of Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester
The XLogP value of 3.5117 indicates that Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester has 1 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 Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester?
The CAS number of Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester is 88486-53-7.
What is the molecular formula of Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester?
The molecular formula of Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester is C14H11BrO3.
What is the molecular weight of Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester?
The molecular weight of Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester is 305.99 g/mol.
Where can I buy Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester?
You can request a quote for Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3-hydroxy-, (4-bromophenyl)methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.