Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene
TL;DR: Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene (CAS 3004-58-8) is a chemical compound with molecular formula C20H28O4 and molecular weight 332.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene
Also Known As: (C8-H14-O2.C8-H8.C4-H6-O2)x-, 2-Propenoic acid, 2-methyl-, polymer with butyl 2-methyl-2-propenoate and ethenylbenzene, butyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; styrene
| Molecular Formula | C20H28O4 |
|---|---|
| Molecular Weight | 332.20 g/mol |
| LogP | 4.8825 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 332.19876 |
| Heavy Atoms | 24 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 3004-58-8 |
|---|---|
| SMILES | CCCCOC(=O)C(=C)C.CC(=C)C(=O)O.C=CC1=CC=CC=C1 |
| InChIKey | MVAUZYMUXCUOQI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene (CAS 3004-58-8), with molecular formula C20H28O4 and molecular weight 332.20 g/mol. IUPAC: butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene.
Chemical Property Profile of Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene
Property Insights of Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene
The XLogP value of 4.8825 indicates that Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene. Following Lipinski's Rule of Five, Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene has 1 hydrogen bond donor(s) and 4 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;2-methylprop-2-enoic acid;styrene?
The CAS number of Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene is 3004-58-8.
What is the molecular formula of Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene?
The molecular formula of Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene is C20H28O4.
What is the molecular weight of Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene?
The molecular weight of Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene is 332.20 g/mol.
Where can I buy Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene?
You can request a quote for Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene 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;2-methylprop-2-enoic acid;styrene?
Yes, KEHONG BIO provides custom synthesis services for Butyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.