2-Ethylhexyl chloroformate
TL;DR: 2-Ethylhexyl chloroformate (CAS 24468-13-1) is a chemical compound with molecular formula C9H17ClO2 and molecular weight 192.0917 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethylhexyl carbonochloridate
Also Known As: 2-Ethylhexyl chloroformate, 2-ethylhexyl carbonochloridate, Octyl chloroformate, Chloroformic acid 2-ethylhexyl ester, 2-ethylhexyl chlorocarbonate
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H17ClO2 |
| Molecular Weight | 192.0917 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 192.0917 Da |
| Heavy Atoms | 12 |
| Complexity | 126.0 |
| Boiling Point | 106 °C @760 [mm Hg] |
| SMILES | CCCCC(CC)COC(=O)Cl |
| InChIKey | RTGLJCSUKOLTEM-UHFFFAOYSA-N |
Chemical Property Profile of 2-Ethylhexyl chloroformate
Property Insights of 2-Ethylhexyl chloroformate
The XLogP value of 4.3 indicates that 2-Ethylhexyl chloroformate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Ethylhexyl chloroformate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethylhexyl 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 2-Ethylhexyl chloroformate?
The CAS number of 2-Ethylhexyl chloroformate is 24468-13-1.
What is the molecular formula of 2-Ethylhexyl chloroformate?
The molecular formula of 2-Ethylhexyl chloroformate is C9H17ClO2.
What is the molecular weight of 2-Ethylhexyl chloroformate?
The molecular weight of 2-Ethylhexyl chloroformate is 192.0917 g/mol.
Where can I buy 2-Ethylhexyl chloroformate?
You can request a quote for 2-Ethylhexyl chloroformate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Ethylhexyl chloroformate?
Yes, CoreyChem provides custom synthesis services for 2-Ethylhexyl chloroformate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.