Citronellyl formate
TL;DR: Citronellyl formate (CAS 105-85-1) is a chemical compound with molecular formula C11H20O2 and molecular weight 184.14633 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,7-dimethyloct-6-enyl formate
Also Known As: Citronellyl formate, 3,7-dimethyloct-6-en-1-yl formate, Rhodinyl formate, Citronellol formate, Citronellyl methanoate
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H20O2 |
| Molecular Weight | 184.14633 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 184.14633 Da |
| Heavy Atoms | 13 |
| Complexity | 157.0 |
| Boiling Point | 235.00 °C. @ 760.00 mm Hg |
| Density | 0.890-0.903 |
| Refractive Index | 1.443-1.452 |
| Solubility | soluble in alcohol, most fixed oils; slightly soluble in propylene glycol; insoluble in glycerin, water |
| SMILES | CC(CCC=C(C)C)CCOC=O |
| InChIKey | DZNVIZQPWLDQHI-UHFFFAOYSA-N |
Product Description
Applications: Citronellyl formate is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Citronellyl formate (CAS 105-85-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Citronellyl formate (CAS 105-85-1) has the molecular formula C11H20O2 and a molecular weight of 184.15 g/mol. Reported properties include a density of 0.890-0.903 g/cm³, a solubility: soluble in alcohol, most fixed oils; slightly soluble in propylene glycol; insoluble in glycerin, water. It is also known as Citronellyl formate and 3,7-dimethyloct-6-en-1-yl formate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Citronellyl formate
Property Insights of Citronellyl formate
The XLogP value of 3.8 indicates that Citronellyl formate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Citronellyl formate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Citronellyl formate 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
What is the CAS number of Citronellyl formate?
The CAS number of Citronellyl formate is 105-85-1.
What is the molecular formula of Citronellyl formate?
The molecular formula of Citronellyl formate is C11H20O2.
What is the molecular weight of Citronellyl formate?
The molecular weight of Citronellyl formate is 184.14633 g/mol.
What are the applications of Citronellyl formate?
Citronellyl formate is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Citronellyl formate (CAS 105-85-1) with custom synthesis available from...
Where can I buy Citronellyl formate?
You can request a quote for Citronellyl formate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Citronellyl formate?
Yes, CoreyChem provides custom synthesis services for Citronellyl formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.