β-氨基丙烯腈
TL;DR: β-氨基丙烯腈 (CAS 24532-82-9) is a chemical compound with molecular formula C3H4N2 and molecular weight 68.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
β-氨基丙烯腈
3-aminoprop-2-enenitrile
Also Known As: beta-aminoacrylonitrile, 2-Propenenitrile, 3-amino-, (E/Z)-3-aminoprop-2-enenitrile, 2-Propenenitrile, 3-amino-, (Z)-
| Molecular Formula | C3H4N2 |
|---|---|
| Molecular Weight | 68.04 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 68.037445 |
| Heavy Atoms | 5 |
| Complexity | 74.0 |
Chemical Identifiers
| CAS Number | 24532-82-9 |
|---|---|
| SMILES | C(=CN)C#N |
| InChIKey | RORTUEWWZUJHTM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
β-氨基丙烯腈 (CAS 24532-82-9), with molecular formula C3H4N2 and molecular weight 68.04 g/mol. IUPAC: 3-aminoprop-2-enenitrile.
Chemical Property Profile of β-氨基丙烯腈
Property Insights of β-氨基丙烯腈
The XLogP value of -0.5 indicates that β-氨基丙烯腈 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.8 Ų, β-氨基丙烯腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, β-氨基丙烯腈 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 β-氨基丙烯腈?
The CAS number of β-氨基丙烯腈 is 24532-82-9.
What is the molecular formula of β-氨基丙烯腈?
The molecular formula of β-氨基丙烯腈 is C3H4N2.
What is the molecular weight of β-氨基丙烯腈?
The molecular weight of β-氨基丙烯腈 is 68.04 g/mol.
Where can I buy β-氨基丙烯腈?
You can request a quote for β-氨基丙烯腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for β-氨基丙烯腈?
Yes, KEHONG BIO provides custom synthesis services for β-氨基丙烯腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.