2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate
TL;DR: 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate (CAS 10378-82-2) is a chemical compound with molecular formula C13H22O3 and molecular weight 226.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(3-ethyl-3-methyloxiran-2-yl)-3-methylpent-1-en-3-yl] acetate
Also Known As: 3,7-Dimethyl-6,7-epoxy-1-nonen-3-yl acetate, 1-(3,4-Epoxy-4-methylhexyl)-1-methylallyl acetate, N,N'-di-2-methylanilide of malonic acid, 3,7-Dimethyl-6,7-epoxy-1-nonen-3-ylacetate, [5-(3-ethyl-3-methyloxiran-2-yl)-3-methylpent-1-en-3-yl] acetate
| Molecular Formula | C13H22O3 |
|---|---|
| Molecular Weight | 226.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 226.15689 |
| Heavy Atoms | 16 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 10378-82-2 |
|---|---|
| SMILES | CCC1(C(O1)CCC(C)(C=C)OC(=O)C)C |
| InChIKey | ZQIIAKHOIHRGSM-UHFFFAOYSA-N |
Product Overview
2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate (CAS 10378-82-2), with molecular formula C13H22O3 and molecular weight 226.16 g/mol. IUPAC: [5-(3-ethyl-3-methyloxiran-2-yl)-3-methylpent-1-en-3-yl] acetate.
Chemical Property Profile of 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate
Property Insights of 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate. With a topological polar surface area (TPSA) of 38.8 Ų, 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate has 0 hydrogen bond donor(s) and 3 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-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate?
The CAS number of 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate is 10378-82-2.
What is the molecular formula of 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate?
The molecular formula of 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate is C13H22O3.
What is the molecular weight of 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate?
The molecular weight of 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate is 226.16 g/mol.
Where can I buy 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate?
You can request a quote for 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxiranepropanol, alpha-ethenyl-3-ethyl-alpha,3-dimethyl-, 2-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.