o-Tolyl chloroformate
TL;DR: o-Tolyl chloroformate (CAS 19358-42-0) is a chemical compound with molecular formula C8H7ClO2 and molecular weight 170.01346 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-methylphenyl) carbonochloridate
Also Known As: o-Tolyl chloroformate, 2-methylphenyl chloroformate, o-tolyl carbonochloridate, 2-methylphenyl carbonochloridate, (2-methylphenyl) carbonochloridate
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H7ClO2 |
| Molecular Weight | 170.01346 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.01346 Da |
| Heavy Atoms | 11 |
| Complexity | 147.0 |
| SMILES | CC1=CC=CC=C1OC(=O)Cl |
| InChIKey | FYFLCWYDZJJMDE-UHFFFAOYSA-N |
Chemical Property Profile of o-Tolyl chloroformate
Property Insights of o-Tolyl chloroformate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for o-Tolyl chloroformate. With a topological polar surface area (TPSA) of 26.3 Ų, o-Tolyl chloroformate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, o-Tolyl chloroformate 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 o-Tolyl chloroformate?
The CAS number of o-Tolyl chloroformate is 19358-42-0.
What is the molecular formula of o-Tolyl chloroformate?
The molecular formula of o-Tolyl chloroformate is C8H7ClO2.
What is the molecular weight of o-Tolyl chloroformate?
The molecular weight of o-Tolyl chloroformate is 170.01346 g/mol.
Where can I buy o-Tolyl chloroformate?
You can request a quote for o-Tolyl chloroformate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for o-Tolyl chloroformate?
Yes, CoreyChem provides custom synthesis services for o-Tolyl chloroformate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.