RefChem:261333
TL;DR: RefChem:261333 (CAS 115039-99-1) is a chemical compound with molecular formula C20H35NO8 and molecular weight 417.23627 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(diethylamino)ethyl 3-(oxolan-2-yl)-2-(oxolan-2-ylmethyl)propanoate;oxalic acid
Also Known As: 2-Diethylaminoethyl 1,3-bis(tetrahydro-2-furyl)propane-2-carboxylate hydrogen oxalate, 1,3,5-trinitro-1,3,5-triazacyclohexan-2-one, 2-Furanpropionic acid, tetrahydro-alpha-(tetrahydrofurfuryl)-, 2-(diethylamino)ethyl ester, oxalate (1:1), 2-(diethylamino)ethyl 3-(oxolan-2-yl)-2-(oxolan-2-ylmethyl)propanoate,oxalic acid, 2-diethylaminoethyl 3-(oxolan-2-yl)-2-(oxolan-2-ylmethyl)propanoate; oxalic acid
Technical Specifications
| Molecular Formula | C20H35NO8 |
| Molecular Weight | 417.23627 g/mol |
| XLogP | 1.7814 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 417.23627 Da |
| Heavy Atoms | 29 |
| Complexity | 399.0 |
| SMILES | CCN(CC)CCOC(=O)C(CC1CCCO1)CC2CCCO2.C(=O)(C(=O)O)O |
| InChIKey | HKWFKYZKGQQEFN-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:261333
Property Insights of RefChem:261333
The XLogP value of 1.7814 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:261333. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:261333. Following Lipinski's Rule of Five, RefChem:261333 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:261333?
The CAS number of RefChem:261333 is 115039-99-1.
What is the molecular formula of RefChem:261333?
The molecular formula of RefChem:261333 is C20H35NO8.
What is the molecular weight of RefChem:261333?
The molecular weight of RefChem:261333 is 417.23627 g/mol.
Where can I buy RefChem:261333?
You can request a quote for RefChem:261333 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:261333?
Yes, CoreyChem provides custom synthesis services for RefChem:261333 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.