Hexanedioic acid--2-ethylhexane-1,3-diol (1/1)
TL;DR: Hexanedioic acid--2-ethylhexane-1,3-diol (1/1) (CAS 53351-10-3) is a chemical compound with molecular formula C14H28O6 and molecular weight 292.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylhexane-1,3-diol;hexanedioic acid
Also Known As: 2-ethylhexane-1,3-diol; hexanedioic acid, (C8-H18-O2.C6-H10-O4)x-, Hexanedioic acid, 2-ethyl-1,3-hexanediol polymer, Hexanedioic acid, polymer with 2-ethyl-1,3-hexanediol, Hexanedioic acid--2-ethylhexane-1,3-diol (1/1)
| Molecular Formula | C14H28O6 |
|---|---|
| Molecular Weight | 292.19 g/mol |
| LogP | 1.8819 |
| Topological Polar Surface Area | 115.06 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 292.1886 |
| Heavy Atoms | 20 |
| Complexity | 234.04869 |
Chemical Identifiers
| CAS Number | 53351-10-3 |
|---|---|
| SMILES | CCCC(C(CC)CO)O.C(CCC(=O)O)CC(=O)O |
Product Overview
Hexanedioic acid--2-ethylhexane-1,3-diol (1/1) (CAS 53351-10-3), with molecular formula C14H28O6 and molecular weight 292.19 g/mol. IUPAC: 2-ethylhexane-1,3-diol;hexanedioic acid.
Chemical Property Profile of Hexanedioic acid--2-ethylhexane-1,3-diol (1/1)
Property Insights of Hexanedioic acid--2-ethylhexane-1,3-diol (1/1)
The XLogP value of 1.8819 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexanedioic acid--2-ethylhexane-1,3-diol (1/1). The TPSA of 115.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexanedioic acid--2-ethylhexane-1,3-diol (1/1). Following Lipinski's Rule of Five, Hexanedioic acid--2-ethylhexane-1,3-diol (1/1) has 4 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 Hexanedioic acid--2-ethylhexane-1,3-diol (1/1)?
The CAS number of Hexanedioic acid--2-ethylhexane-1,3-diol (1/1) is 53351-10-3.
What is the molecular formula of Hexanedioic acid--2-ethylhexane-1,3-diol (1/1)?
The molecular formula of Hexanedioic acid--2-ethylhexane-1,3-diol (1/1) is C14H28O6.
What is the molecular weight of Hexanedioic acid--2-ethylhexane-1,3-diol (1/1)?
The molecular weight of Hexanedioic acid--2-ethylhexane-1,3-diol (1/1) is 292.19 g/mol.
Where can I buy Hexanedioic acid--2-ethylhexane-1,3-diol (1/1)?
You can request a quote for Hexanedioic acid--2-ethylhexane-1,3-diol (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexanedioic acid--2-ethylhexane-1,3-diol (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Hexanedioic acid--2-ethylhexane-1,3-diol (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.