N-乙基环己胺
TL;DR: N-乙基环己胺 (CAS 5459-93-8) is a chemical compound with molecular formula C8H17N and molecular weight 127.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-乙基环己胺
N-ethylcyclohexanamine
Also Known As: N-Ethylcyclohexylamine, N-Ethylcyclohexanamine, Vulkacit HX, N-Cyclohexylethylamine, Accelerator HX
| Molecular Formula | C8H17N |
|---|---|
| Molecular Weight | 127.14 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 127.1361 |
| Heavy Atoms | 9 |
| Complexity | 65.0 |
| Melting Point | -45.0 °C |
| Boiling Point | 165.0 °C at 760 mmHg |
| Density | 0.8527 at 25.0 °C - Less dense than water; will float |
| Solubility | SLIGHTLY SOL IN WATER; SOL IN ALL PROP IN ALCOHOL, ETHER |
| Flash Point | 29.4 °C ; 46.1 °C (cc) |
Chemical Identifiers
| CAS Number | 5459-93-8 |
|---|---|
| SMILES | CCNC1CCCCC1 |
| InChIKey | AGVKXDPPPSLISR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-乙基环己胺 (CAS 5459-93-8), with molecular formula C8H17N and molecular weight 127.14 g/mol. IUPAC: N-ethylcyclohexanamine.
Chemical Property Profile of N-乙基环己胺
Property Insights of N-乙基环己胺
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-乙基环己胺. With a topological polar surface area (TPSA) of 12.0 Ų, N-乙基环己胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-乙基环己胺 has 1 hydrogen bond donor(s) and 1 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 N-乙基环己胺?
The CAS number of N-乙基环己胺 is 5459-93-8.
What is the molecular formula of N-乙基环己胺?
The molecular formula of N-乙基环己胺 is C8H17N.
What is the molecular weight of N-乙基环己胺?
The molecular weight of N-乙基环己胺 is 127.14 g/mol.
Where can I buy N-乙基环己胺?
You can request a quote for N-乙基环己胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-乙基环己胺?
Yes, KEHONG BIO provides custom synthesis services for N-乙基环己胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.