3-(己氧基)丙胺
TL;DR: 3-(己氧基)丙胺 (CAS 16728-61-3) is a chemical compound with molecular formula C9H21NO and molecular weight 159.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(己氧基)丙胺
3-hexoxypropan-1-amine
Also Known As: 3-(Hexyloxy)propylamine, 3-hexoxypropan-1-amine, 1-Propanamine, 3-(hexyloxy)-, 3-HEXYLOXYPROPYLAMINE, 3-(hexyloxy)propan-1-amine
| Molecular Formula | C9H21NO |
|---|---|
| Molecular Weight | 159.16 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 159.16231 |
| Heavy Atoms | 11 |
| Complexity | 66.0 |
Chemical Identifiers
| CAS Number | 16728-61-3 |
|---|---|
| SMILES | CCCCCCOCCCN |
| InChIKey | NWGJTXNNXLHFSE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(己氧基)丙胺 (CAS 16728-61-3), with molecular formula C9H21NO and molecular weight 159.16 g/mol. IUPAC: 3-hexoxypropan-1-amine.
Chemical Property Profile of 3-(己氧基)丙胺
Property Insights of 3-(己氧基)丙胺
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(己氧基)丙胺. With a topological polar surface area (TPSA) of 35.3 Ų, 3-(己氧基)丙胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(己氧基)丙胺 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 3-(己氧基)丙胺?
The CAS number of 3-(己氧基)丙胺 is 16728-61-3.
What is the molecular formula of 3-(己氧基)丙胺?
The molecular formula of 3-(己氧基)丙胺 is C9H21NO.
What is the molecular weight of 3-(己氧基)丙胺?
The molecular weight of 3-(己氧基)丙胺 is 159.16 g/mol.
Where can I buy 3-(己氧基)丙胺?
You can request a quote for 3-(己氧基)丙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(己氧基)丙胺?
Yes, KEHONG BIO provides custom synthesis services for 3-(己氧基)丙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.