2,3-Dibromohexanoic acid
TL;DR: 2,3-Dibromohexanoic acid (CAS 95658-28-9) is a chemical compound with molecular formula C6H10Br2O2 and molecular weight 271.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dibromohexanoic acid
Also Known As: 2,3-dibromohexanoic acid, 2,3-dibromo-hexanoic acid, NCIOpen2_003895
| Molecular Formula | C6H10Br2O2 |
|---|---|
| Molecular Weight | 271.90 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.90475 |
| Heavy Atoms | 10 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 95658-28-9 |
|---|---|
| SMILES | CCCC(C(C(=O)O)Br)Br |
| InChIKey | FGZJHRRUZOQKDJ-UHFFFAOYSA-N |
Product Overview
2,3-Dibromohexanoic acid (CAS 95658-28-9), with molecular formula C6H10Br2O2 and molecular weight 271.90 g/mol. IUPAC: 2,3-dibromohexanoic acid.
Chemical Property Profile of 2,3-Dibromohexanoic acid
Property Insights of 2,3-Dibromohexanoic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dibromohexanoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2,3-Dibromohexanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dibromohexanoic 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 2,3-Dibromohexanoic acid?
The CAS number of 2,3-Dibromohexanoic acid is 95658-28-9.
What is the molecular formula of 2,3-Dibromohexanoic acid?
The molecular formula of 2,3-Dibromohexanoic acid is C6H10Br2O2.
What is the molecular weight of 2,3-Dibromohexanoic acid?
The molecular weight of 2,3-Dibromohexanoic acid is 271.90 g/mol.
Where can I buy 2,3-Dibromohexanoic acid?
You can request a quote for 2,3-Dibromohexanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dibromohexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dibromohexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.