N-Allylethylenediamine
TL;DR: N-Allylethylenediamine (CAS 40510-22-3) is a chemical compound with molecular formula C5H12N2 and molecular weight 100.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-prop-2-enylethane-1,2-diamine
Also Known As: n-allylethylenediamine, Ethylenediamine, N-allyl-, N-allyl-ethylenediamine, N-allylethylendiamine, N1-allylethane-1,2-diamine
| Molecular Formula | C5H12N2 |
|---|---|
| Molecular Weight | 100.10 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 100.10005 |
| Heavy Atoms | 7 |
| Complexity | 43.0 |
Chemical Identifiers
| CAS Number | 40510-22-3 |
|---|---|
| SMILES | C=CCNCCN |
| InChIKey | YDLDORZAYJTSMR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Allylethylenediamine (CAS 40510-22-3), with molecular formula C5H12N2 and molecular weight 100.10 g/mol. IUPAC: N'-prop-2-enylethane-1,2-diamine.
Chemical Property Profile of N-Allylethylenediamine
Property Insights of N-Allylethylenediamine
The XLogP value of -0.5 indicates that N-Allylethylenediamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.1 Ų, N-Allylethylenediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Allylethylenediamine has 2 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 N-Allylethylenediamine?
The CAS number of N-Allylethylenediamine is 40510-22-3.
What is the molecular formula of N-Allylethylenediamine?
The molecular formula of N-Allylethylenediamine is C5H12N2.
What is the molecular weight of N-Allylethylenediamine?
The molecular weight of N-Allylethylenediamine is 100.10 g/mol.
Where can I buy N-Allylethylenediamine?
You can request a quote for N-Allylethylenediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Allylethylenediamine?
Yes, KEHONG BIO provides custom synthesis services for N-Allylethylenediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.