3,4,5-Tribromobenzoic acid
TL;DR: 3,4,5-Tribromobenzoic acid (CAS 618-74-6) is a chemical compound with molecular formula C7H3Br3O2 and molecular weight 355.77 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-tribromobenzoic acid
Also Known As: 3,4,5-Tribromobenzoic acid, 3,4,5-Tribomobenzoic acid, Benzoic acid, 3,4,5-tribromo-, See 27539 t for high purity material, 3,4,5-Tribromobenzoic acid - technical grade
| Molecular Formula | C7H3Br3O2 |
|---|---|
| Molecular Weight | 355.77 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 355.7683 |
| Heavy Atoms | 12 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 618-74-6 |
|---|---|
| SMILES | C1=C(C=C(C(=C1Br)Br)Br)C(=O)O |
| InChIKey | UDZOUVAHFWHQEL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4,5-Tribromobenzoic acid (CAS 618-74-6), with molecular formula C7H3Br3O2 and molecular weight 355.77 g/mol. IUPAC: 3,4,5-tribromobenzoic acid.
Chemical Property Profile of 3,4,5-Tribromobenzoic acid
Property Insights of 3,4,5-Tribromobenzoic acid
The XLogP value of 3.5 indicates that 3,4,5-Tribromobenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3,4,5-Tribromobenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5-Tribromobenzoic acid 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 3,4,5-Tribromobenzoic acid?
The CAS number of 3,4,5-Tribromobenzoic acid is 618-74-6.
What is the molecular formula of 3,4,5-Tribromobenzoic acid?
The molecular formula of 3,4,5-Tribromobenzoic acid is C7H3Br3O2.
What is the molecular weight of 3,4,5-Tribromobenzoic acid?
The molecular weight of 3,4,5-Tribromobenzoic acid is 355.77 g/mol.
Where can I buy 3,4,5-Tribromobenzoic acid?
You can request a quote for 3,4,5-Tribromobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5-Tribromobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5-Tribromobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.