梨酯
TL;DR: 梨酯 (CAS 3025-30-7) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
梨酯
ethyl deca-2,4-dienoate
Also Known As: Athyldecadienoat, ethyl deca-2,4-dienoate, Ethyl-2,4-decadienoate, Ethyl 2,4-decadienoate, Decadienoic acid, ethyl ester
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 3025-30-7 |
|---|---|
| SMILES | CCCCCC=CC=CC(=O)OCC |
| InChIKey | OPCRGEVPIBLWAY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
梨酯 (CAS 3025-30-7), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: ethyl deca-2,4-dienoate.
Chemical Property Profile of 梨酯
Property Insights of 梨酯
The XLogP value of 4.0 indicates that 梨酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 梨酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 梨酯 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 梨酯?
The CAS number of 梨酯 is 3025-30-7.
What is the molecular formula of 梨酯?
The molecular formula of 梨酯 is C12H20O2.
What is the molecular weight of 梨酯?
The molecular weight of 梨酯 is 196.15 g/mol.
Where can I buy 梨酯?
You can request a quote for 梨酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 梨酯?
Yes, KEHONG BIO provides custom synthesis services for 梨酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.