Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile
TL;DR: Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile (CAS 51316-12-2) is a chemical compound with molecular formula C18H29NO4 and molecular weight 323.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile
Also Known As: Butyl methacrylate, butyl acrylate, acrylonitrile polymer, (C8-H14-O2.C7-H12-O2.C3-H3-N)x-, butyl 2-methylprop-2-enoate; butyl prop-2-enoate; prop-2-enenitrile, 2-Propenoic acid, 2-methyl-, butyl ester, polymer with butyl 2-propenoate and 2-propenenitrile, Butyl 2-propenoate, 2-propenenitrile, butyl 2-methyl-2-propenoate polymer
| Molecular Formula | C18H29NO4 |
|---|---|
| Molecular Weight | 323.21 g/mol |
| LogP | 4.11748 |
| Topological Polar Surface Area | 76.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 323.20966 |
| Heavy Atoms | 23 |
| Complexity | 394.31598 |
Chemical Identifiers
| CAS Number | 51316-12-2 |
|---|---|
| SMILES | CCCCOC(=O)C=C.CCCCOC(=O)C(=C)C.C=CC#N |
Product Overview
Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile (CAS 51316-12-2), with molecular formula C18H29NO4 and molecular weight 323.21 g/mol. IUPAC: butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile.
Chemical Property Profile of Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile
Property Insights of Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile
The XLogP value of 4.11748 indicates that Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile. Following Lipinski's Rule of Five, Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile has 0 hydrogen bond donor(s) and 5 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 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile?
The CAS number of Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile is 51316-12-2.
What is the molecular formula of Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile?
The molecular formula of Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile is C18H29NO4.
What is the molecular weight of Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile?
The molecular weight of Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile is 323.21 g/mol.
Where can I buy Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile?
You can request a quote for Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for Butyl 2-methylprop-2-enoate;butyl prop-2-enoate;prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.