Dimethyl benzyl carbinyl acetate
TL;DR: Dimethyl benzyl carbinyl acetate (CAS 151-05-3) is a chemical compound with molecular formula C12H16O2 and molecular weight 192.11504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-methyl-1-phenylpropan-2-yl) acetate
Also Known As: Dimethylbenzylcarbinyl acetate, Dmbca, Benzylpropyl acetate, 2-methyl-1-phenylpropan-2-yl acetate, Dimethyl benzyl carbinyl acetate
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H16O2 |
| Molecular Weight | 192.11504 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 192.11504 Da |
| Heavy Atoms | 14 |
| Complexity | 190.0 |
| Melting Point | 30 °C |
| Density | 0.995-1.002 |
| Refractive Index | 1.490-1.495 |
| Solubility | Soluble in mineral oil, most fixed oils and propylene glycol; insoluble in water |
| SMILES | CC(=O)OC(C)(C)CC1=CC=CC=C1 |
| InChIKey | FLUWAIIVLCVEKF-UHFFFAOYSA-N |
Product Description
Applications: Dimethyl benzyl carbinyl acetate 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. CoreyChem supplies Dimethyl benzyl carbinyl acetate (CAS 151-05-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A surfactant raw material supplied by CoreyChem, Dimethyl benzyl carbinyl acetate (CAS 151-05-3) has the molecular formula C12H16O2 and a molecular weight of 192.12 g/mol. Reported properties include a density of 0.995-1.002 g/cm³, a solubility: Soluble in mineral oil, most fixed oils and propylene glycol; insoluble in water. It is also known as Dimethylbenzylcarbinyl acetate and Dmbca.
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 Dimethyl benzyl carbinyl acetate
Property Insights of Dimethyl benzyl carbinyl acetate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl benzyl carbinyl acetate. With a topological polar surface area (TPSA) of 26.3 Ų, Dimethyl benzyl carbinyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl benzyl carbinyl acetate 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 Dimethyl benzyl carbinyl acetate?
The CAS number of Dimethyl benzyl carbinyl acetate is 151-05-3.
What is the molecular formula of Dimethyl benzyl carbinyl acetate?
The molecular formula of Dimethyl benzyl carbinyl acetate is C12H16O2.
What is the molecular weight of Dimethyl benzyl carbinyl acetate?
The molecular weight of Dimethyl benzyl carbinyl acetate is 192.11504 g/mol.
What are the applications of Dimethyl benzyl carbinyl acetate?
Dimethyl benzyl carbinyl acetate 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. CoreyChem supplies Dimethyl benzyl carbinyl acetate (CAS 151-05-3) with custom...
Where can I buy Dimethyl benzyl carbinyl acetate?
You can request a quote for Dimethyl benzyl carbinyl acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dimethyl benzyl carbinyl acetate?
Yes, CoreyChem provides custom synthesis services for Dimethyl benzyl carbinyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.