alpha-Methylbenzyl formate
TL;DR: alpha-Methylbenzyl formate (CAS 153824-54-5) is a chemical compound with molecular formula C9H10O2 and molecular weight 150.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-phenylethyl formate
Also Known As: 1-Phenylethyl formate, Styralyl formate, alpha-Methylbenzyl formate, alpha-Phenylethyl formate, 1-Phenyl-1-ethyl formate
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H10O2 |
| Molecular Weight | 150.06808 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 150.06808 Da |
| Heavy Atoms | 11 |
| Complexity | 117.0 |
| SMILES | CC(C1=CC=CC=C1)OC=O |
| InChIKey | RUDZCBJWUDOPTP-UHFFFAOYSA-N |
Chemical Property Profile of alpha-Methylbenzyl formate
Property Insights of alpha-Methylbenzyl formate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Methylbenzyl formate. With a topological polar surface area (TPSA) of 26.3 Ų, alpha-Methylbenzyl formate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Methylbenzyl 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 alpha-Methylbenzyl formate?
The CAS number of alpha-Methylbenzyl formate is 153824-54-5.
What is the molecular formula of alpha-Methylbenzyl formate?
The molecular formula of alpha-Methylbenzyl formate is C9H10O2.
What is the molecular weight of alpha-Methylbenzyl formate?
The molecular weight of alpha-Methylbenzyl formate is 150.06808 g/mol.
Where can I buy alpha-Methylbenzyl formate?
You can request a quote for alpha-Methylbenzyl formate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for alpha-Methylbenzyl formate?
Yes, CoreyChem provides custom synthesis services for alpha-Methylbenzyl formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.