1-(2-Hydroxyethyl) hexanedioate
TL;DR: 1-(2-Hydroxyethyl) hexanedioate (CAS 94109-19-0) is a chemical compound with molecular formula C8H14O5 and molecular weight 190.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-hydroxyethoxy)-6-oxohexanoic acid
Also Known As: (2-Hydroxyethyl) hydrogen adipate, 6-(2-hydroxyethoxy)-6-oxohexanoic acid, 6-(2-hydroxyethoxy)-6-oxoheracicacid, EINECS 302-457-4, 1-(2-HYDROXYETHYL) HEXANEDIOATE
| Molecular Formula | C8H14O5 |
|---|---|
| Molecular Weight | 190.08 g/mol |
| LogP | 0.1669 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 190.08412 |
| Heavy Atoms | 13 |
| Complexity | 165.91733 |
Chemical Identifiers
| CAS Number | 94109-19-0 |
|---|---|
| SMILES | C(CCC(=O)OCCO)CC(=O)O |
Product Overview
1-(2-Hydroxyethyl) hexanedioate (CAS 94109-19-0), with molecular formula C8H14O5 and molecular weight 190.08 g/mol. IUPAC: 6-(2-hydroxyethoxy)-6-oxohexanoic acid.
Chemical Property Profile of 1-(2-Hydroxyethyl) hexanedioate
Property Insights of 1-(2-Hydroxyethyl) hexanedioate
The XLogP value of 0.1669 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Hydroxyethyl) hexanedioate. The TPSA of 83.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Hydroxyethyl) hexanedioate. Following Lipinski's Rule of Five, 1-(2-Hydroxyethyl) hexanedioate has 2 hydrogen bond donor(s) and 4 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 1-(2-Hydroxyethyl) hexanedioate?
The CAS number of 1-(2-Hydroxyethyl) hexanedioate is 94109-19-0.
What is the molecular formula of 1-(2-Hydroxyethyl) hexanedioate?
The molecular formula of 1-(2-Hydroxyethyl) hexanedioate is C8H14O5.
What is the molecular weight of 1-(2-Hydroxyethyl) hexanedioate?
The molecular weight of 1-(2-Hydroxyethyl) hexanedioate is 190.08 g/mol.
Where can I buy 1-(2-Hydroxyethyl) hexanedioate?
You can request a quote for 1-(2-Hydroxyethyl) hexanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Hydroxyethyl) hexanedioate?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Hydroxyethyl) hexanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.