n-Prop-2-yn-1-ylprop-2-en-1-amine
TL;DR: n-Prop-2-yn-1-ylprop-2-en-1-amine (CAS 42268-68-8) is a chemical compound with molecular formula C6H9N and molecular weight 95.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-prop-2-ynylprop-2-en-1-amine
Also Known As: allylpropargylamine, Allyl-prop-2-ynyl-amine, n-prop-2-yn-1-ylprop-2-en-1-amine, N-Allylpropargylamine, N-prop-2-ynylprop-2-en-1-amine
| Molecular Formula | C6H9N |
|---|---|
| Molecular Weight | 95.07 g/mol |
| LogP | 0.3952 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 95.0735 |
| Heavy Atoms | 7 |
| Complexity | 78.671036 |
Chemical Identifiers
| CAS Number | 42268-68-8 |
|---|---|
| SMILES | C=CCNCC#C |
Product Overview
n-Prop-2-yn-1-ylprop-2-en-1-amine (CAS 42268-68-8), with molecular formula C6H9N and molecular weight 95.07 g/mol. IUPAC: N-prop-2-ynylprop-2-en-1-amine.
Chemical Property Profile of n-Prop-2-yn-1-ylprop-2-en-1-amine
Property Insights of n-Prop-2-yn-1-ylprop-2-en-1-amine
The XLogP value of 0.3952 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-Prop-2-yn-1-ylprop-2-en-1-amine. With a topological polar surface area (TPSA) of 12.03 Ų, n-Prop-2-yn-1-ylprop-2-en-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Prop-2-yn-1-ylprop-2-en-1-amine 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-Prop-2-yn-1-ylprop-2-en-1-amine?
The CAS number of n-Prop-2-yn-1-ylprop-2-en-1-amine is 42268-68-8.
What is the molecular formula of n-Prop-2-yn-1-ylprop-2-en-1-amine?
The molecular formula of n-Prop-2-yn-1-ylprop-2-en-1-amine is C6H9N.
What is the molecular weight of n-Prop-2-yn-1-ylprop-2-en-1-amine?
The molecular weight of n-Prop-2-yn-1-ylprop-2-en-1-amine is 95.07 g/mol.
Where can I buy n-Prop-2-yn-1-ylprop-2-en-1-amine?
You can request a quote for n-Prop-2-yn-1-ylprop-2-en-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Prop-2-yn-1-ylprop-2-en-1-amine?
Yes, KEHONG BIO provides custom synthesis services for n-Prop-2-yn-1-ylprop-2-en-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.