2-Ethylheptyl propionate
TL;DR: 2-Ethylheptyl propionate (CAS 94200-08-5) is a chemical compound with molecular formula C12H24O2 and molecular weight 200.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylheptyl propanoate
Also Known As: 2-Ethylheptyl propionate, 2-ethylheptyl propanoate, EINECS 303-484-4, Propionic acid 2-ethylheptyl ester
| Molecular Formula | C12H24O2 |
|---|---|
| Molecular Weight | 200.18 g/mol |
| LogP | 3.5461 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 200.17763 |
| Heavy Atoms | 14 |
| Complexity | 143.25716 |
Chemical Identifiers
| CAS Number | 94200-08-5 |
|---|---|
| SMILES | CCCCCC(CC)COC(=O)CC |
Product Overview
2-Ethylheptyl propionate (CAS 94200-08-5), with molecular formula C12H24O2 and molecular weight 200.18 g/mol. IUPAC: 2-ethylheptyl propanoate.
Chemical Property Profile of 2-Ethylheptyl propionate
Property Insights of 2-Ethylheptyl propionate
The XLogP value of 3.5461 indicates that 2-Ethylheptyl propionate 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-Ethylheptyl propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethylheptyl propionate 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
Frequently Asked Questions
What is the CAS number of 2-Ethylheptyl propionate?
The CAS number of 2-Ethylheptyl propionate is 94200-08-5.
What is the molecular formula of 2-Ethylheptyl propionate?
The molecular formula of 2-Ethylheptyl propionate is C12H24O2.
What is the molecular weight of 2-Ethylheptyl propionate?
The molecular weight of 2-Ethylheptyl propionate is 200.18 g/mol.
Where can I buy 2-Ethylheptyl propionate?
You can request a quote for 2-Ethylheptyl propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylheptyl propionate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylheptyl propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.