3-氨基辛酸
TL;DR: 3-氨基辛酸 (CAS 104883-49-0) is a chemical compound with molecular formula C8H17NO2 and molecular weight 159.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-氨基辛酸
3-aminooctanoic acid
Also Known As: 3-aminooctanoic acid, 3-amino-octanoic acid, 3-aminocaprylic acid, 3-aminooctanoicacid, beta-aminocaprylic acid
| Molecular Formula | C8H17NO2 |
|---|---|
| Molecular Weight | 159.13 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 159.12593 |
| Heavy Atoms | 11 |
| Complexity | 115.0 |
Chemical Identifiers
| CAS Number | 104883-49-0 |
|---|---|
| SMILES | CCCCCC(CC(=O)O)N |
| InChIKey | FYHHDJRMDOBZJF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-氨基辛酸 (CAS 104883-49-0), with molecular formula C8H17NO2 and molecular weight 159.13 g/mol. IUPAC: 3-aminooctanoic acid.
Chemical Property Profile of 3-氨基辛酸
Property Insights of 3-氨基辛酸
The XLogP value of -1.1 indicates that 3-氨基辛酸 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 3-氨基辛酸. Following Lipinski's Rule of Five, 3-氨基辛酸 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 3-氨基辛酸?
The CAS number of 3-氨基辛酸 is 104883-49-0.
What is the molecular formula of 3-氨基辛酸?
The molecular formula of 3-氨基辛酸 is C8H17NO2.
What is the molecular weight of 3-氨基辛酸?
The molecular weight of 3-氨基辛酸 is 159.13 g/mol.
Where can I buy 3-氨基辛酸?
You can request a quote for 3-氨基辛酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-氨基辛酸?
Yes, KEHONG BIO provides custom synthesis services for 3-氨基辛酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.