四溴山梨酸
TL;DR: 四溴山梨酸 (CAS 62284-99-5) is a chemical compound with molecular formula C6H8Br4O2 and molecular weight 427.73 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
四溴山梨酸
2,3,4,5-tetrabromohexanoic acid
Also Known As: Tetrabromosorbic acid, 2,3,4,5-Tetrabromocaproic acid, 2,3,4,5-tetrabromohexanoic acid, Hexanoic acid, 2,3,4,5-tetrabromo-
| Molecular Formula | C6H8Br4O2 |
|---|---|
| Molecular Weight | 427.73 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 427.72577 |
| Heavy Atoms | 12 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 62284-99-5 |
|---|---|
| SMILES | CC(C(C(C(C(=O)O)Br)Br)Br)Br |
| InChIKey | YRJBPNJXIREPGC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
四溴山梨酸 (CAS 62284-99-5), with molecular formula C6H8Br4O2 and molecular weight 427.73 g/mol. IUPAC: 2,3,4,5-tetrabromohexanoic acid.
Chemical Property Profile of 四溴山梨酸
Property Insights of 四溴山梨酸
The XLogP value of 3.5 indicates that 四溴山梨酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 四溴山梨酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 四溴山梨酸 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 四溴山梨酸?
The CAS number of 四溴山梨酸 is 62284-99-5.
What is the molecular formula of 四溴山梨酸?
The molecular formula of 四溴山梨酸 is C6H8Br4O2.
What is the molecular weight of 四溴山梨酸?
The molecular weight of 四溴山梨酸 is 427.73 g/mol.
Where can I buy 四溴山梨酸?
You can request a quote for 四溴山梨酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 四溴山梨酸?
Yes, KEHONG BIO provides custom synthesis services for 四溴山梨酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.