Orange Oil
TL;DR: Orange Oil (CAS 8028-48-6) is a chemical compound with molecular formula C15H22O and molecular weight 218.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethyl-10-methylidenedodeca-2,6,11-trienal
Also Known As: Orange oil, Orange terpenes, beta-Sinensal, Citrus Sinenses, Citrus sinensis oil
| Molecular Formula | C15H22O |
|---|---|
| Molecular Weight | 218.17 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Exact Mass | 218.16707 |
| Heavy Atoms | 16 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 8028-48-6 |
|---|---|
| SMILES | CC(=CCCC(=C)C=C)CCC=C(C)C=O |
| InChIKey | NOPLRNXKHZRXHT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Orange Oil (CAS 8028-48-6), with molecular formula C15H22O and molecular weight 218.17 g/mol. IUPAC: 2,6-dimethyl-10-methylidenedodeca-2,6,11-trienal.
Chemical Property Profile of Orange Oil
Property Insights of Orange Oil
The XLogP value of 4.8 indicates that Orange Oil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Orange Oil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Orange Oil has 0 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 Orange Oil?
The CAS number of Orange Oil is 8028-48-6.
What is the molecular formula of Orange Oil?
The molecular formula of Orange Oil is C15H22O.
What is the molecular weight of Orange Oil?
The molecular weight of Orange Oil is 218.17 g/mol.
Where can I buy Orange Oil?
You can request a quote for Orange Oil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Orange Oil?
Yes, KEHONG BIO provides custom synthesis services for Orange Oil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.