Neopentyl glycol dimethacrylate
TL;DR: Neopentyl glycol dimethacrylate (CAS 1985-51-9) is a chemical compound with molecular formula C13H20O4 and molecular weight 240.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,2-dimethyl-3-(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate
Also Known As: Neopentyl glycol dimethacrylate, Neopentanediol dimethacrylate, 2,2-Dimethylpropane-1,3-diyl bis(2-methylacrylate), LIGHT ESTER NP, Ibuprofen Impurity 97
| Molecular Formula | C13H20O4 |
|---|---|
| Molecular Weight | 240.14 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 240.13615 |
| Heavy Atoms | 17 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 1985-51-9 |
|---|---|
| SMILES | CC(=C)C(=O)OCC(C)(C)COC(=O)C(=C)C |
| InChIKey | ULQMPOIOSDXIGC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Neopentyl glycol dimethacrylate (CAS 1985-51-9), with molecular formula C13H20O4 and molecular weight 240.14 g/mol. IUPAC: [2,2-dimethyl-3-(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate.
Chemical Property Profile of Neopentyl glycol dimethacrylate
Property Insights of Neopentyl glycol dimethacrylate
The XLogP value of 3.1 indicates that Neopentyl glycol dimethacrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Neopentyl glycol dimethacrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Neopentyl glycol dimethacrylate has 0 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 Neopentyl glycol dimethacrylate?
The CAS number of Neopentyl glycol dimethacrylate is 1985-51-9.
What is the molecular formula of Neopentyl glycol dimethacrylate?
The molecular formula of Neopentyl glycol dimethacrylate is C13H20O4.
What is the molecular weight of Neopentyl glycol dimethacrylate?
The molecular weight of Neopentyl glycol dimethacrylate is 240.14 g/mol.
Where can I buy Neopentyl glycol dimethacrylate?
You can request a quote for Neopentyl glycol dimethacrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Neopentyl glycol dimethacrylate?
Yes, KEHONG BIO provides custom synthesis services for Neopentyl glycol dimethacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.