2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester
TL;DR: 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester (CAS 67905-48-0) is a chemical compound with molecular formula C12H18O5 and molecular weight 242.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-hydroxy-6-prop-2-enoyloxyhexyl) prop-2-enoate
Also Known As: 2-Hydroxy-1,6-hexanediyl diacrylate, 1,2,6-Hexanetriol 1,6-diacrylate, 2-Hydroxyhexane-1,6-diyl diacrylate, 2-Propenoic acid, 2-hydroxy-1,6-hexanediyl ester, 2-Hydroxyhexane-1,6-diyl diprop-2-enoate
| Molecular Formula | C12H18O5 |
|---|---|
| Molecular Weight | 242.12 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 242.11542 |
| Heavy Atoms | 17 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 67905-48-0 |
|---|---|
| SMILES | C=CC(=O)OCCCCC(COC(=O)C=C)O |
| InChIKey | MFFPEGFXNIFWDL-UHFFFAOYSA-N |
Product Overview
2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester (CAS 67905-48-0), with molecular formula C12H18O5 and molecular weight 242.12 g/mol. IUPAC: (5-hydroxy-6-prop-2-enoyloxyhexyl) prop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester
Property Insights of 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester. Following Lipinski's Rule of Five, 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester has 1 hydrogen bond donor(s) and 5 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-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester?
The CAS number of 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester is 67905-48-0.
What is the molecular formula of 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester?
The molecular formula of 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester is C12H18O5.
What is the molecular weight of 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester?
The molecular weight of 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester is 242.12 g/mol.
Where can I buy 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester?
You can request a quote for 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 1,1'-(2-hydroxy-1,6-hexanediyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.