N-Allylbenzylamine
TL;DR: N-Allylbenzylamine (CAS 4383-22-6) is a chemical compound with molecular formula C10H13N and molecular weight 147.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzylprop-2-en-1-amine
Also Known As: N-Allylbenzylamine, N-benzylprop-2-en-1-amine, N-allyl-N-benzylamine, allylbenzylamine, benzylallylamine
| Molecular Formula | C10H13N |
|---|---|
| Molecular Weight | 147.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 147.1048 |
| Heavy Atoms | 11 |
| Complexity | 103.0 |
Chemical Identifiers
| CAS Number | 4383-22-6 |
|---|---|
| SMILES | C=CCNCC1=CC=CC=C1 |
| InChIKey | RHUCQDQRNUUMKY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Allylbenzylamine (CAS 4383-22-6), with molecular formula C10H13N and molecular weight 147.10 g/mol. IUPAC: N-benzylprop-2-en-1-amine.
Chemical Property Profile of N-Allylbenzylamine
Property Insights of N-Allylbenzylamine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Allylbenzylamine. With a topological polar surface area (TPSA) of 12.0 Ų, N-Allylbenzylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Allylbenzylamine 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-Allylbenzylamine?
The CAS number of N-Allylbenzylamine is 4383-22-6.
What is the molecular formula of N-Allylbenzylamine?
The molecular formula of N-Allylbenzylamine is C10H13N.
What is the molecular weight of N-Allylbenzylamine?
The molecular weight of N-Allylbenzylamine is 147.10 g/mol.
Where can I buy N-Allylbenzylamine?
You can request a quote for N-Allylbenzylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Allylbenzylamine?
Yes, KEHONG BIO provides custom synthesis services for N-Allylbenzylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.