prune glycidate
TL;DR: prune glycidate (CAS 67905-40-2) is a chemical compound with molecular formula C16H24O3 and molecular weight 264.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-methyl-3-[2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethenyl]oxirane-2-carboxylate
Also Known As: prune glycidate, METHYL ALPHA IONONE GLYCIDATE, Oxiranecarboxylic acid, 3-methyl-3-[2-(2,6,6-trimethyl-2-cyclohexen-1-yl)ethenyl]-, methyl ester, methyl 3-methyl-3-[2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethenyl]oxirane-2-carboxylate, Methyl 3-methyl-3-(2-(2,6,6-trimethylcyclohex-2-en-1-yl)vinyl)oxirane-2-carboxylate
| Molecular Formula | C16H24O3 |
|---|---|
| Molecular Weight | 264.17 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.17255 |
| Heavy Atoms | 19 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 67905-40-2 |
|---|---|
| SMILES | CC1=CCCC(C1C=CC2(C(O2)C(=O)OC)C)(C)C |
| InChIKey | WOCOGWMEEYJGLH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
prune glycidate (CAS 67905-40-2), with molecular formula C16H24O3 and molecular weight 264.17 g/mol. IUPAC: methyl 3-methyl-3-[2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethenyl]oxirane-2-carboxylate.
Chemical Property Profile of prune glycidate
Property Insights of prune glycidate
The XLogP value of 3.1 indicates that prune glycidate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, prune glycidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, prune glycidate 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 prune glycidate?
The CAS number of prune glycidate is 67905-40-2.
What is the molecular formula of prune glycidate?
The molecular formula of prune glycidate is C16H24O3.
What is the molecular weight of prune glycidate?
The molecular weight of prune glycidate is 264.17 g/mol.
Where can I buy prune glycidate?
You can request a quote for prune glycidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for prune glycidate?
Yes, KEHONG BIO provides custom synthesis services for prune glycidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.