N-Benzylbut-3-en-1-amine
TL;DR: N-Benzylbut-3-en-1-amine (CAS 17150-62-8) is a chemical compound with molecular formula C11H15N and molecular weight 161.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzylbut-3-en-1-amine
Also Known As: N-benzylbut-3-en-1-amine, N-benzyl-3-butenylamine, N-Benzyl-N-(3-butenyl)amine, benzylbutenylamine, benzyl(but-3-en-1-yl)amine
| Molecular Formula | C11H15N |
|---|---|
| Molecular Weight | 161.12 g/mol |
| LogP | 2.3523 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 161.12045 |
| Heavy Atoms | 12 |
| Complexity | 215.70554 |
Chemical Identifiers
| CAS Number | 17150-62-8 |
|---|---|
| SMILES | C=CCCNCC1=CC=CC=C1 |
Product Overview
N-Benzylbut-3-en-1-amine (CAS 17150-62-8), with molecular formula C11H15N and molecular weight 161.12 g/mol. IUPAC: N-benzylbut-3-en-1-amine.
Chemical Property Profile of N-Benzylbut-3-en-1-amine
Property Insights of N-Benzylbut-3-en-1-amine
The XLogP value of 2.3523 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzylbut-3-en-1-amine. With a topological polar surface area (TPSA) of 12.03 Ų, N-Benzylbut-3-en-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Benzylbut-3-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-Benzylbut-3-en-1-amine?
The CAS number of N-Benzylbut-3-en-1-amine is 17150-62-8.
What is the molecular formula of N-Benzylbut-3-en-1-amine?
The molecular formula of N-Benzylbut-3-en-1-amine is C11H15N.
What is the molecular weight of N-Benzylbut-3-en-1-amine?
The molecular weight of N-Benzylbut-3-en-1-amine is 161.12 g/mol.
Where can I buy N-Benzylbut-3-en-1-amine?
You can request a quote for N-Benzylbut-3-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-Benzylbut-3-en-1-amine?
Yes, KEHONG BIO provides custom synthesis services for N-Benzylbut-3-en-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.