4-氰基苄胺
TL;DR: 4-氰基苄胺 (CAS 10406-25-4) is a chemical compound with molecular formula C8H8N2 and molecular weight 132.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氰基苄胺
4-(aminomethyl)benzonitrile
Also Known As: 4-Cyanobenzylamine, 4-(Aminomethyl)benzonitrile, p-cyanobenzylamine, 4-cyanobenzyl amine, Benzonitrile, 4-(aminomethyl)-
| Molecular Formula | C8H8N2 |
|---|---|
| Molecular Weight | 132.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 132.06874 |
| Heavy Atoms | 10 |
| Complexity | 137.0 |
Chemical Identifiers
| CAS Number | 10406-25-4 |
|---|---|
| SMILES | C1=CC(=CC=C1CN)C#N |
| InChIKey | LFIWXXXFJFOECP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氰基苄胺 (CAS 10406-25-4), with molecular formula C8H8N2 and molecular weight 132.07 g/mol. IUPAC: 4-(aminomethyl)benzonitrile.
Chemical Property Profile of 4-氰基苄胺
Property Insights of 4-氰基苄胺
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-氰基苄胺. With a topological polar surface area (TPSA) of 49.8 Ų, 4-氰基苄胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-氰基苄胺 has 1 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 4-氰基苄胺?
The CAS number of 4-氰基苄胺 is 10406-25-4.
What is the molecular formula of 4-氰基苄胺?
The molecular formula of 4-氰基苄胺 is C8H8N2.
What is the molecular weight of 4-氰基苄胺?
The molecular weight of 4-氰基苄胺 is 132.07 g/mol.
Where can I buy 4-氰基苄胺?
You can request a quote for 4-氰基苄胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氰基苄胺?
Yes, KEHONG BIO provides custom synthesis services for 4-氰基苄胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.