5-Bromopent-4-enoic acid
TL;DR: 5-Bromopent-4-enoic acid (CAS 88663-50-7) is a chemical compound with molecular formula C5H7BrO2 and molecular weight 177.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-5-bromopent-4-enoic acid
Also Known As: 5-bromopent-4-enoic acid, (E)-5-bromopent-4-enoic acid, (4E)-5-BROMOPENT-4-ENOIC ACID, 4-pentenoic acid, 5-bromo-, 4-Pentenoic acid, 5-bromo-, (E)-
| Molecular Formula | C5H7BrO2 |
|---|---|
| Molecular Weight | 177.96 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 177.96294 |
| Heavy Atoms | 8 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 88663-50-7 |
|---|---|
| SMILES | C(CC(=O)O)/C=C/Br |
| InChIKey | HRLPFOBWURFZAS-DUXPYHPUSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Bromopent-4-enoic acid (CAS 88663-50-7), with molecular formula C5H7BrO2 and molecular weight 177.96 g/mol. IUPAC: (E)-5-bromopent-4-enoic acid.
Chemical Property Profile of 5-Bromopent-4-enoic acid
Property Insights of 5-Bromopent-4-enoic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromopent-4-enoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 5-Bromopent-4-enoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromopent-4-enoic 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 5-Bromopent-4-enoic acid?
The CAS number of 5-Bromopent-4-enoic acid is 88663-50-7.
What is the molecular formula of 5-Bromopent-4-enoic acid?
The molecular formula of 5-Bromopent-4-enoic acid is C5H7BrO2.
What is the molecular weight of 5-Bromopent-4-enoic acid?
The molecular weight of 5-Bromopent-4-enoic acid is 177.96 g/mol.
Where can I buy 5-Bromopent-4-enoic acid?
You can request a quote for 5-Bromopent-4-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromopent-4-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromopent-4-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.