Diallylethylamine
TL;DR: Diallylethylamine (CAS 3454-10-2) is a chemical compound with molecular formula C8H15N and molecular weight 125.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-prop-2-enylprop-2-en-1-amine
Also Known As: Diallylethylamine, ethyldiallylamine, N,N-Diallylethylamine, ethylbis(prop-2-en-1-yl)amine, N-allyl-N-ethylprop-2-en-1-amine
| Molecular Formula | C8H15N |
|---|---|
| Molecular Weight | 125.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 125.12045 |
| Heavy Atoms | 9 |
| Complexity | 76.0 |
Chemical Identifiers
| CAS Number | 3454-10-2 |
|---|---|
| SMILES | CCN(CC=C)CC=C |
| InChIKey | BGDTWOQNFJNCKH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diallylethylamine (CAS 3454-10-2), with molecular formula C8H15N and molecular weight 125.12 g/mol. IUPAC: N-ethyl-N-prop-2-enylprop-2-en-1-amine.
Chemical Property Profile of Diallylethylamine
Property Insights of Diallylethylamine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diallylethylamine. With a topological polar surface area (TPSA) of 3.2 Ų, Diallylethylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diallylethylamine has 0 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 Diallylethylamine?
The CAS number of Diallylethylamine is 3454-10-2.
What is the molecular formula of Diallylethylamine?
The molecular formula of Diallylethylamine is C8H15N.
What is the molecular weight of Diallylethylamine?
The molecular weight of Diallylethylamine is 125.12 g/mol.
Where can I buy Diallylethylamine?
You can request a quote for Diallylethylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diallylethylamine?
Yes, KEHONG BIO provides custom synthesis services for Diallylethylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.