RefChem:411119
TL;DR: RefChem:411119 (CAS 96511-35-2) is a chemical compound with molecular formula C15H16O7 and molecular weight 308.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-(2-hydroxyethyl) 2-O-(2-prop-2-enoyloxyethyl) benzene-1,2-dicarboxylate
Also Known As: 2-Acryloyloxyethyl 2-hydroxyethyl phthalate, 2-Hydroxyethyl 2-acryloyloxyethyl phthalate, 2-(acryloyloxy)ethyl 2-hydroxyethyl phthalate, Phthalic acid, 2-hydroxyethyl 2-(2-propenoyloxy)ethyl ester, 1,2-Benzenedicarboxylic acid, 1-(2-hydroxyethyl) 2-(2-((1-oxo-2-propen-1-yl)oxy)ethyl) ester
| Molecular Formula | C15H16O7 |
|---|---|
| Molecular Weight | 308.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 308.0896 |
| Heavy Atoms | 22 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 96511-35-2 |
|---|---|
| SMILES | C=CC(=O)OCCOC(=O)C1=CC=CC=C1C(=O)OCCO |
| InChIKey | OEURXIFGOPBMJF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:411119 (CAS 96511-35-2), with molecular formula C15H16O7 and molecular weight 308.09 g/mol. IUPAC: 1-O-(2-hydroxyethyl) 2-O-(2-prop-2-enoyloxyethyl) benzene-1,2-dicarboxylate.
Chemical Property Profile of RefChem:411119
Property Insights of RefChem:411119
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:411119. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:411119. Following Lipinski's Rule of Five, RefChem:411119 has 1 hydrogen bond donor(s) and 7 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 RefChem:411119?
The CAS number of RefChem:411119 is 96511-35-2.
What is the molecular formula of RefChem:411119?
The molecular formula of RefChem:411119 is C15H16O7.
What is the molecular weight of RefChem:411119?
The molecular weight of RefChem:411119 is 308.09 g/mol.
Where can I buy RefChem:411119?
You can request a quote for RefChem:411119 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:411119?
Yes, KEHONG BIO provides custom synthesis services for RefChem:411119 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.