Benzoic acid, 3,5-dibromo-
TL;DR: Benzoic acid, 3,5-dibromo- (CAS 618-58-6) is a chemical compound with molecular formula C7H4Br2O2 and molecular weight 277.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dibromobenzoic acid
Also Known As: 3,5-Dibromobenzoic acid, null, Benzoicacid, 3,5-dibromo-, BENZOIC ACID, 3,5-DIBROMO-, 3,5-Dibromobenzoicacid
| Molecular Formula | C7H4Br2O2 |
|---|---|
| Molecular Weight | 277.86 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 279.85577 |
| Heavy Atoms | 11 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 618-58-6 |
|---|---|
| SMILES | C1=C(C=C(C=C1Br)Br)C(=O)O |
| InChIKey | SFTFNJZWZHASAQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, 3,5-dibromo- (CAS 618-58-6), with molecular formula C7H4Br2O2 and molecular weight 277.86 g/mol. IUPAC: 3,5-dibromobenzoic acid.
Chemical Property Profile of Benzoic acid, 3,5-dibromo-
Property Insights of Benzoic acid, 3,5-dibromo-
The XLogP value of 3.0 indicates that Benzoic acid, 3,5-dibromo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Benzoic acid, 3,5-dibromo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 3,5-dibromo- has 1 hydrogen bond donor(s) and 2 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, 3,5-dibromo-?
The CAS number of Benzoic acid, 3,5-dibromo- is 618-58-6.
What is the molecular formula of Benzoic acid, 3,5-dibromo-?
The molecular formula of Benzoic acid, 3,5-dibromo- is C7H4Br2O2.
What is the molecular weight of Benzoic acid, 3,5-dibromo-?
The molecular weight of Benzoic acid, 3,5-dibromo- is 277.86 g/mol.
Where can I buy Benzoic acid, 3,5-dibromo-?
You can request a quote for Benzoic acid, 3,5-dibromo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3,5-dibromo-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3,5-dibromo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.