乙酸橙花酯
TL;DR: 乙酸橙花酯 (CAS 141-12-8) 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.
乙酸橙花酯
5,9-dimethyldeca-4,8-dienoic acid
Also Known As: 5,9-Dimethyl-4,8-decadienoic acid, 4,8-Decadienoic acid,5,9-dimethyl-, 5,9-DIMETHYLDECA-4,8-DIENOIC ACID, (4Z)-5,9-dimethyldeca-4,8-dienoic acid
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 3.5439 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 232.70628 |
Chemical Identifiers
| CAS Number | 141-12-8 |
|---|---|
| SMILES | CC(=CCCC(=CCCC(=O)O)C)C |
Product Overview
乙酸橙花酯 (CAS 141-12-8), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: 5,9-dimethyldeca-4,8-dienoic acid.
Chemical Property Profile of 乙酸橙花酯
Property Insights of 乙酸橙花酯
The XLogP value of 3.5439 indicates that 乙酸橙花酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 乙酸橙花酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 乙酸橙花酯 has 1 hydrogen bond donor(s) and 1 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 乙酸橙花酯?
The CAS number of 乙酸橙花酯 is 141-12-8.
What is the molecular formula of 乙酸橙花酯?
The molecular formula of 乙酸橙花酯 is C12H20O2.
What is the molecular weight of 乙酸橙花酯?
The molecular weight of 乙酸橙花酯 is 196.15 g/mol.
Where can I buy 乙酸橙花酯?
You can request a quote for 乙酸橙花酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙酸橙花酯?
Yes, KEHONG BIO provides custom synthesis services for 乙酸橙花酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.