Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1)
TL;DR: Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1) (CAS 58593-17-2) is a chemical compound with molecular formula C16H22O2 and molecular weight 246.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl prop-2-enoate;1-ethenyl-2-methylbenzene
Also Known As: (C9-H10.C7-H12-O2)x-, butyl prop-2-enoate; 1-ethenyl-2-methylbenzene, 2-Propenoic acid, butyl ester, ethenylmethylbenzene polymer, 2-Propenoic acid, butyl ester, polymer with ethenylmethylbenzene, Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1)
| Molecular Formula | C16H22O2 |
|---|---|
| Molecular Weight | 246.16 g/mol |
| LogP | 4.15372 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.16199 |
| Heavy Atoms | 18 |
| Complexity | 380.4383 |
Chemical Identifiers
| CAS Number | 58593-17-2 |
|---|---|
| SMILES | CCCCOC(=O)C=C.CC1=CC=CC=C1C=C |
Product Overview
Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1) (CAS 58593-17-2), with molecular formula C16H22O2 and molecular weight 246.16 g/mol. IUPAC: butyl prop-2-enoate;1-ethenyl-2-methylbenzene.
Chemical Property Profile of Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1)
Property Insights of Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1)
The XLogP value of 4.15372 indicates that Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1) has 0 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 Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1)?
The CAS number of Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1) is 58593-17-2.
What is the molecular formula of Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1)?
The molecular formula of Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1) is C16H22O2.
What is the molecular weight of Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1)?
The molecular weight of Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1) is 246.16 g/mol.
Where can I buy Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1)?
You can request a quote for Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1) 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--1-ethenyl-2-methylbenzene (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Butyl prop-2-enoate--1-ethenyl-2-methylbenzene (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.