4-氨基-5-己烯酸
TL;DR: 4-氨基-5-己烯酸 (CAS 60643-86-9) is a chemical compound with molecular formula C6H11NO2 and molecular weight 129.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氨基-5-己烯酸
4-aminohex-5-enoic acid
Also Known As: vigabatrin, Sabril, 4-aminohex-5-enoic acid, Vigabatrine, gamma-Vinyl GABA
| Molecular Formula | C6H11NO2 |
|---|---|
| Molecular Weight | 129.08 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 129.07898 |
| Heavy Atoms | 9 |
| Complexity | 112.0 |
| Melting Point | 171-176C |
| Solubility | 55.1 |
Chemical Identifiers
| CAS Number | 60643-86-9 |
|---|---|
| SMILES | C=CC(CCC(=O)O)N |
| InChIKey | PJDFLNIOAUIZSL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氨基-5-己烯酸 (CAS 60643-86-9), with molecular formula C6H11NO2 and molecular weight 129.08 g/mol. IUPAC: 4-aminohex-5-enoic acid.
Chemical Property Profile of 4-氨基-5-己烯酸
Property Insights of 4-氨基-5-己烯酸
The XLogP value of -2.2 indicates that 4-氨基-5-己烯酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-氨基-5-己烯酸. Following Lipinski's Rule of Five, 4-氨基-5-己烯酸 has 2 hydrogen bond donor(s) and 3 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 4-氨基-5-己烯酸?
The CAS number of 4-氨基-5-己烯酸 is 60643-86-9.
What is the molecular formula of 4-氨基-5-己烯酸?
The molecular formula of 4-氨基-5-己烯酸 is C6H11NO2.
What is the molecular weight of 4-氨基-5-己烯酸?
The molecular weight of 4-氨基-5-己烯酸 is 129.08 g/mol.
Where can I buy 4-氨基-5-己烯酸?
You can request a quote for 4-氨基-5-己烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氨基-5-己烯酸?
Yes, KEHONG BIO provides custom synthesis services for 4-氨基-5-己烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.