2,2-Bis((allyloxy)methyl)butyl acetate
TL;DR: 2,2-Bis((allyloxy)methyl)butyl acetate (CAS 67385-21-1) is a chemical compound with molecular formula C14H24O4 and molecular weight 256.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-2-ethyl-5-methoxy-2-[(E)-3-methoxyprop-2-enyl]pent-4-enyl] acetate
Also Known As: EINECS 266-676-6, 2,2-Bis((allyloxy)methyl)butyl acetate, 1-Butanol, 2,2-bis((2-propenyloxy)methyl)-, acetate, 1-Butanol, 2,2-bis((2-propen-1-yloxy)methyl)-, 1-acetate, 2-Ethyl-2-(hydroxymethyl)-1,3-propanediol diallyl ether acetate
| Molecular Formula | C14H24O4 |
|---|---|
| Molecular Weight | 256.17 g/mol |
| LogP | 3.0463 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 256.16745 |
| Heavy Atoms | 18 |
| Complexity | 265.5186 |
Chemical Identifiers
| CAS Number | 67385-21-1 |
|---|---|
| SMILES | CCC(COC(=O)C)(C/C=C/OC)C/C=C/OC |
Product Overview
2,2-Bis((allyloxy)methyl)butyl acetate (CAS 67385-21-1), with molecular formula C14H24O4 and molecular weight 256.17 g/mol. IUPAC: [(E)-2-ethyl-5-methoxy-2-[(E)-3-methoxyprop-2-enyl]pent-4-enyl] acetate.
Chemical Property Profile of 2,2-Bis((allyloxy)methyl)butyl acetate
Property Insights of 2,2-Bis((allyloxy)methyl)butyl acetate
The XLogP value of 3.0463 indicates that 2,2-Bis((allyloxy)methyl)butyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.76 Ų, 2,2-Bis((allyloxy)methyl)butyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Bis((allyloxy)methyl)butyl acetate has 0 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 2,2-Bis((allyloxy)methyl)butyl acetate?
The CAS number of 2,2-Bis((allyloxy)methyl)butyl acetate is 67385-21-1.
What is the molecular formula of 2,2-Bis((allyloxy)methyl)butyl acetate?
The molecular formula of 2,2-Bis((allyloxy)methyl)butyl acetate is C14H24O4.
What is the molecular weight of 2,2-Bis((allyloxy)methyl)butyl acetate?
The molecular weight of 2,2-Bis((allyloxy)methyl)butyl acetate is 256.17 g/mol.
Where can I buy 2,2-Bis((allyloxy)methyl)butyl acetate?
You can request a quote for 2,2-Bis((allyloxy)methyl)butyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Bis((allyloxy)methyl)butyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Bis((allyloxy)methyl)butyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.