Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene
TL;DR: Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene (CAS 30954-73-5) is a chemical compound with molecular formula C21H27NO4 and molecular weight 357.19 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;prop-2-enoic acid;styrene
Also Known As: 2-Propenoic acid, polymer with butyl 2-propenoate, ethenylbenzene and 2-propenenitrile, acrylic acid; butyl prop-2-enoate; prop-2-enenitrile; styrene, (C8-H8.C7-H12-O2.C3-H4-O2.C3-H3-N)x-, butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene, Styrene, butyl acrylate, acrylic acid, acrylonitrile polymer
| Molecular Formula | C21H27NO4 |
|---|---|
| Molecular Weight | 357.19 g/mol |
| LogP | 4.79828 |
| Topological Polar Surface Area | 87.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 357.194 |
| Heavy Atoms | 26 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 30954-73-5 |
|---|---|
| SMILES | CCCCOC(=O)C=C.C=CC#N.C=CC1=CC=CC=C1.C=CC(=O)O |
| InChIKey | UPMATSCYHGMGSE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene (CAS 30954-73-5), with molecular formula C21H27NO4 and molecular weight 357.19 g/mol. IUPAC: butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene.
Chemical Property Profile of Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene
Property Insights of Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene
The XLogP value of 4.79828 indicates that Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene. Following Lipinski's Rule of Five, Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene has 1 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 prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene?
The CAS number of Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene is 30954-73-5.
What is the molecular formula of Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene?
The molecular formula of Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene is C21H27NO4.
What is the molecular weight of Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene?
The molecular weight of Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene is 357.19 g/mol.
Where can I buy Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene?
You can request a quote for Butyl prop-2-enoate;prop-2-enenitrile;prop-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 prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene?
Yes, KEHONG BIO provides custom synthesis services for Butyl prop-2-enoate;prop-2-enenitrile;prop-2-enoic acid;styrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.