Butyl acrylate acrylonitrile
TL;DR: Butyl acrylate acrylonitrile (CAS 9082-08-0) is a chemical compound with molecular formula C10H15NO2 and molecular weight 181.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl prop-2-enoate;prop-2-enenitrile
Also Known As: butyl acrylate acrylonitrile, acrylonitrile n-butyl acrylate, n-butyl acrylate acrylonitrile, Butyl acrylate, acrylonitrile polymer, Acrylonitrile polymer with butyl acrylate
| Molecular Formula | C10H15NO2 |
|---|---|
| Molecular Weight | 181.11 g/mol |
| LogP | 2.21168 |
| Topological Polar Surface Area | 50.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 181.11028 |
| Heavy Atoms | 13 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 9082-08-0 |
|---|---|
| SMILES | CCCCOC(=O)C=C.C=CC#N |
| InChIKey | QSMOHLASMMAGIB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyl acrylate acrylonitrile (CAS 9082-08-0), with molecular formula C10H15NO2 and molecular weight 181.11 g/mol. IUPAC: butyl prop-2-enoate;prop-2-enenitrile.
Chemical Property Profile of Butyl acrylate acrylonitrile
Property Insights of Butyl acrylate acrylonitrile
The XLogP value of 2.21168 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl acrylate acrylonitrile. With a topological polar surface area (TPSA) of 50.1 Ų, Butyl acrylate acrylonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl acrylate acrylonitrile has 0 hydrogen bond donor(s) and 3 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 Butyl acrylate acrylonitrile?
The CAS number of Butyl acrylate acrylonitrile is 9082-08-0.
What is the molecular formula of Butyl acrylate acrylonitrile?
The molecular formula of Butyl acrylate acrylonitrile is C10H15NO2.
What is the molecular weight of Butyl acrylate acrylonitrile?
The molecular weight of Butyl acrylate acrylonitrile is 181.11 g/mol.
Where can I buy Butyl acrylate acrylonitrile?
You can request a quote for Butyl acrylate acrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl acrylate acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for Butyl acrylate acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.