Musk ketone
TL;DR: Musk ketone (CAS 81-14-1) is a chemical compound with molecular formula C14H18N2O5 and molecular weight 294.12158 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-tert-butyl-2,6-dimethyl-3,5-dinitrophenyl)ethanone
Also Known As: MUSK KETONE, Ketone moschus, Muskketone, Ketone musk, Acephenone
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H18N2O5 |
| Molecular Weight | 294.12158 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.12158 Da |
| Heavy Atoms | 21 |
| Complexity | 418.0 |
| Melting Point | 274.1 to 277.7 °F (NTP, 1992) |
| Density | Relative density: 0.73 g/cu cm |
| Flash Point | >168 °C (>334 °F) - closed cup |
| Vapor Pressure | 3.00X10-7 mm Hg at 25 °C |
| Solubility | Insoluble (<1 mg/ml at 68.0 °F) (NTP, 1992) |
| SMILES | CC1=C(C(=C(C(=C1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-])C)C(=O)C |
| InChIKey | WXCMHFPAUCOJIG-UHFFFAOYSA-N |
Product Description
Applications: Musk ketone is used in surfactant and detergent formulations, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Musk ketone is a surfactant raw material identified by CAS number 81-14-1 and the molecular formula C14H18N2O5 and a molecular weight of 294.12 g/mol. Physically, the compound has a density of Relative density: 0.73 g/cu cm g/cm³, a solubility: Insoluble (<1 mg/ml at 68.0 °F) (NTP, 1992). Synonyms include MUSK KETONE and Ketone moschus.
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 Musk ketone
Property Insights of Musk ketone
The XLogP value of 3.7 indicates that Musk ketone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Musk ketone. Following Lipinski's Rule of Five, Musk ketone has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Musk ketone?
The CAS number of Musk ketone is 81-14-1.
What is the molecular formula of Musk ketone?
The molecular formula of Musk ketone is C14H18N2O5.
What is the molecular weight of Musk ketone?
The molecular weight of Musk ketone is 294.12158 g/mol.
What are the applications of Musk ketone?
Musk ketone is used in surfactant and detergent formulations, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with...
Where can I buy Musk ketone?
You can request a quote for Musk ketone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Musk ketone?
Yes, CoreyChem provides custom synthesis services for Musk ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.